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Imidazopyrimidines

Organic heterocyclic compounds that contain an imidazole ring fused to a pyrimidine ring. Imidazole is five-membered ring with three carbon atoms and two nitrogen atoms; pyrimidine is a six-membered ring with four carbon atoms and two nitrogen atoms.
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Keyword Search:
1 – 15 of 36 results
1

Theophylline-7-acetic acid, 98%

CAS: 652-37-9 Molecular Formula: C9H9N4NaO4 Molecular Weight (g/mol): 260.19 MDL Number: MFCD00022832 InChI Key: MSFVZSOKOXZSME-UHFFFAOYSA-M Synonym: acefylline,theophylline-7-acetic acid,acephylline,theophyllineacetic acid,carboxymethyltheophylline,7-carboxymethyl theophylline,7-theophyllinylacetic acid,theophyllin-7-ylacetic acid,7-theophyllinessigsaeure,7-theophyllineacetic acid PubChem CID: 69550 IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid SMILES: [Na+].CN1C2=C(N(CC([O-])=O)C=N2)C(=O)N(C)C1=O

PubChem CID 69550
CAS 652-37-9
Molecular Weight (g/mol) 260.19
MDL Number MFCD00022832
SMILES [Na+].CN1C2=C(N(CC([O-])=O)C=N2)C(=O)N(C)C1=O
Synonym acefylline,theophylline-7-acetic acid,acephylline,theophyllineacetic acid,carboxymethyltheophylline,7-carboxymethyl theophylline,7-theophyllinylacetic acid,theophyllin-7-ylacetic acid,7-theophyllinessigsaeure,7-theophyllineacetic acid
IUPAC Name 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid
InChI Key MSFVZSOKOXZSME-UHFFFAOYSA-M
Molecular Formula C9H9N4NaO4
2

Uric acid, 99%, Thermo Scientific Chemicals

CAS: 69-93-2 Molecular Formula: C5H4N4O3 Molecular Weight (g/mol): 168.112 MDL Number: MFCD00005712 InChI Key: LEHOTFFKMJEONL-UHFFFAOYSA-N Synonym: uric acid,urate,2,6,8-trioxypurine,lithic acid,2,6,8-trihydroxypurine,2,6,8-trioxopurine,1h-purine-2,6,8-triol,8-hydroxyxanthine,7,9-dihydro-1h-purine-2,6,8 3h-trione,1h-purine-2,6,8 3h-trione, 7,9-dihydro PubChem CID: 1175 ChEBI: CHEBI:17775 IUPAC Name: 7,9-dihydro-3H-purine-2,6,8-trione SMILES: C12=C(NC(=O)N1)NC(=O)NC2=O

PubChem CID 1175
CAS 69-93-2
Molecular Weight (g/mol) 168.112
ChEBI CHEBI:17775
MDL Number MFCD00005712
SMILES C12=C(NC(=O)N1)NC(=O)NC2=O
Synonym uric acid,urate,2,6,8-trioxypurine,lithic acid,2,6,8-trihydroxypurine,2,6,8-trioxopurine,1h-purine-2,6,8-triol,8-hydroxyxanthine,7,9-dihydro-1h-purine-2,6,8 3h-trione,1h-purine-2,6,8 3h-trione, 7,9-dihydro
IUPAC Name 7,9-dihydro-3H-purine-2,6,8-trione
InChI Key LEHOTFFKMJEONL-UHFFFAOYSA-N
Molecular Formula C5H4N4O3
3

Acyclovir Acetate, TRC

CAS: 102728-64-3 Molecular Formula: C10 H13 N5 O4 Molecular Weight (g/mol): 267.24 Synonym: 2-[(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy]ethyl Acetate,Valaciclovir Hydrochloride Anhydrous Imp. I (EP),Aciclovir Imp. A (EP),Aciclovir Acetate,Acyclovir Acetate IUPAC Name: 2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]ethyl acetate SMILES: CC(=O)OCCOCn1cnc2C(=O)NC(=Nc12)N

CAS 102728-64-3
Molecular Weight (g/mol) 267.24
SMILES CC(=O)OCCOCn1cnc2C(=O)NC(=Nc12)N
Synonym 2-[(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy]ethyl Acetate,Valaciclovir Hydrochloride Anhydrous Imp. I (EP),Aciclovir Imp. A (EP),Aciclovir Acetate,Acyclovir Acetate
IUPAC Name 2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]ethyl acetate
Molecular Formula C10 H13 N5 O4
4

Uric acid, 99% max., MP Biomedicals™

CAS: 69-93-2 Molecular Formula: C5H4N4O3 Molecular Weight (g/mol): 168.112 InChI Key: LEHOTFFKMJEONL-UHFFFAOYSA-N Synonym: uric acid,urate,2,6,8-trioxypurine,lithic acid,2,6,8-trihydroxypurine,2,6,8-trioxopurine,1h-purine-2,6,8-triol,8-hydroxyxanthine,7,9-dihydro-1h-purine-2,6,8 3h-trione,1h-purine-2,6,8 3h-trione, 7,9-dihydro PubChem CID: 1175 ChEBI: CHEBI:17775 IUPAC Name: 7,9-dihydro-3H-purine-2,6,8-trione SMILES: C12=C(NC(=O)N1)NC(=O)NC2=O

PubChem CID 1175
CAS 69-93-2
Molecular Weight (g/mol) 168.112
ChEBI CHEBI:17775
SMILES C12=C(NC(=O)N1)NC(=O)NC2=O
Synonym uric acid,urate,2,6,8-trioxypurine,lithic acid,2,6,8-trihydroxypurine,2,6,8-trioxopurine,1h-purine-2,6,8-triol,8-hydroxyxanthine,7,9-dihydro-1h-purine-2,6,8 3h-trione,1h-purine-2,6,8 3h-trione, 7,9-dihydro
IUPAC Name 7,9-dihydro-3H-purine-2,6,8-trione
InChI Key LEHOTFFKMJEONL-UHFFFAOYSA-N
Molecular Formula C5H4N4O3
5

Uric Acid, TRC

CAS: 69-93-2 Molecular Formula: C5 H4 N4 O3 Molecular Weight (g/mol): 168.11 Synonym: 7,9-Dihydro-1H-purine-2,6,8(3H)-trione (ACI),Uric acid (8CI),1H-Purine-2,6,8-triol,2,3,6,7,8,9-Hexahydro-1H-purine-2,6,8-trione,2,6,8-Trihydroxypurine,2,6,8-Trioxopurine,2,6,8-Trioxypurine,Lithic acid,NSC 3975,Purine-2,6,8(1H,3H,9H)-trione,1H-Purine-2,6,8(3H)-trione, 7,9-dihydro- (9CI, ACI) IUPAC Name: 7,9-dihydro-3H-purine-2,6,8-trione SMILES: O=C1NC(=O)C2=C(NC(=O)N2)N1

CAS 69-93-2
Molecular Weight (g/mol) 168.11
SMILES O=C1NC(=O)C2=C(NC(=O)N2)N1
Synonym 7,9-Dihydro-1H-purine-2,6,8(3H)-trione (ACI),Uric acid (8CI),1H-Purine-2,6,8-triol,2,3,6,7,8,9-Hexahydro-1H-purine-2,6,8-trione,2,6,8-Trihydroxypurine,2,6,8-Trioxopurine,2,6,8-Trioxypurine,Lithic acid,NSC 3975,Purine-2,6,8(1H,3H,9H)-trione,1H-Purine-2,6,8(3H)-trione, 7,9-dihydro- (9CI, ACI)
IUPAC Name 7,9-dihydro-3H-purine-2,6,8-trione
Molecular Formula C5 H4 N4 O3
6

1,3-Dimethyluric Acid, TRC

CAS: 944-73-0 Molecular Formula: C7H8N4O3 Molecular Weight (g/mol): 196.16 Synonym: 7,9-Dihydro-1,3-dimethyl-1H-purine-2,6,8(3H)-trione,1,3-Dimethyl Uric Acid; IUPAC Name: 1,3-dimethyl-7,9-dihydropurine-2,6,8-trione SMILES: CN1C(=O)N(C)C2=C(NC(=O)N2)C1=O

CAS 944-73-0
Molecular Weight (g/mol) 196.16
SMILES CN1C(=O)N(C)C2=C(NC(=O)N2)C1=O
Synonym 7,9-Dihydro-1,3-dimethyl-1H-purine-2,6,8(3H)-trione,1,3-Dimethyl Uric Acid;
IUPAC Name 1,3-dimethyl-7,9-dihydropurine-2,6,8-trione
Molecular Formula C7H8N4O3
7

1-Methyluric Acid, TRC

CAS: 708-79-2 Molecular Formula: C6 H6 N4 O3 Molecular Weight (g/mol): 182.14 Synonym: 7,9-Dihydro-1-methyl-1H-purine-2,6,8(3H)-trione,1-Methyl-uric Acid; IUPAC Name: 1-methyl-7,9-dihydro-3H-purine-2,6,8-trione SMILES: CN1C(=O)NC2=C(NC(=O)N2)C1=O

CAS 708-79-2
Molecular Weight (g/mol) 182.14
SMILES CN1C(=O)NC2=C(NC(=O)N2)C1=O
Synonym 7,9-Dihydro-1-methyl-1H-purine-2,6,8(3H)-trione,1-Methyl-uric Acid;
IUPAC Name 1-methyl-7,9-dihydro-3H-purine-2,6,8-trione
Molecular Formula C6 H6 N4 O3
8

Uric Acid-1,3-15N2, TRC

CAS: 62948-75-8 Molecular Formula: C5 H4 15N2 N2 O3 Molecular Weight (g/mol): 170.1 Synonym: 7,9-dihydro-1H-Purine-2,6,8(3H)-trione-1,3-15N2 IUPAC Name: 7,9-dihydro-3H-purine-2,6,8-trione SMILES: O=C1[15NH]C(=O)C2=C([15NH]1)NC(=O)N2

CAS 62948-75-8
Molecular Weight (g/mol) 170.1
SMILES O=C1[15NH]C(=O)C2=C([15NH]1)NC(=O)N2
Synonym 7,9-dihydro-1H-Purine-2,6,8(3H)-trione-1,3-15N2
IUPAC Name 7,9-dihydro-3H-purine-2,6,8-trione
Molecular Formula C5 H4 15N2 N2 O3
9

Phytic acid dodecasodium hydrate, MedChemExpress

MedChemExpress Phytic acid (Inositol hexaphosphate) dodecasodium hydrate is a phosphorus storage compound of seeds and cereal grains.

ENCOMPASS_PREFERRED
10

Acefylline, MedChemExpress

MedChemExpress Acefylline (Theophyllineacetic acid), a xanthine derivative, is an adenosine receptor antagonist. Acefylline is a peptidylarginine deiminase (PAD) activator. Acefylline is also a bronchodilator, which inhibits rat lung cAMP phosphodiesterase isoenzymes.

ENCOMPASS_PREFERRED
11
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Caffeine, 98.5%, specified according to the req. of USP/BP

CAS: 58-08-2 Molecular Formula: C8H10N4O2 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00005758 InChI Key: RYYVLZVUVIJVGH-UHFFFAOYSA-N Synonym: caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep PubChem CID: 2519 ChEBI: CHEBI:27732 IUPAC Name: 1,3,7-trimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C

EDGE
PubChem CID 2519
CAS 58-08-2
Molecular Weight (g/mol) 194.19
ChEBI CHEBI:27732
MDL Number MFCD00005758
SMILES CN1C=NC2=C1C(=O)N(C)C(=O)N2C
Synonym caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep
IUPAC Name 1,3,7-trimethylpurine-2,6-dione
InChI Key RYYVLZVUVIJVGH-UHFFFAOYSA-N
Molecular Formula C8H10N4O2
12

9-Carboxymethoxymethylguanine, TRC

CAS: 80685-22-9 Molecular Formula: C8 H9 N5 O4 Molecular Weight (g/mol): 239.19 Synonym: Acetic acid, 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-,Acetic acid, [(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]- (9CI),9-Carboxymethoxymethylguanine IUPAC Name: 2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]acetic acid SMILES: NC1=Nc2c(ncn2COCC(=O)O)C(=O)N1

CAS 80685-22-9
Molecular Weight (g/mol) 239.19
SMILES NC1=Nc2c(ncn2COCC(=O)O)C(=O)N1
Synonym Acetic acid, 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-,Acetic acid, [(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]- (9CI),9-Carboxymethoxymethylguanine
IUPAC Name 2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]acetic acid
Molecular Formula C8 H9 N5 O4
13

Caffeine, 99.7%

CAS: 58-08-2 Molecular Formula: C8H10N4O2 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00005758 InChI Key: RYYVLZVUVIJVGH-UHFFFAOYSA-N Synonym: caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep PubChem CID: 2519 ChEBI: CHEBI:27732 IUPAC Name: 1,3,7-trimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C

PubChem CID 2519
CAS 58-08-2
Molecular Weight (g/mol) 194.19
ChEBI CHEBI:27732
MDL Number MFCD00005758
SMILES CN1C=NC2=C1C(=O)N(C)C(=O)N2C
Synonym caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep
IUPAC Name 1,3,7-trimethylpurine-2,6-dione
InChI Key RYYVLZVUVIJVGH-UHFFFAOYSA-N
Molecular Formula C8H10N4O2
14

Caffeine, 99%

CAS: 58-08-2 Molecular Formula: C8H10N4O2 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00005758 InChI Key: RYYVLZVUVIJVGH-UHFFFAOYSA-N Synonym: caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep PubChem CID: 2519 ChEBI: CHEBI:27732 SMILES: CN1C=NC2=C1C(=O)N(C)C(=O)N2C

PubChem CID 2519
CAS 58-08-2
Molecular Weight (g/mol) 194.19
ChEBI CHEBI:27732
MDL Number MFCD00005758
SMILES CN1C=NC2=C1C(=O)N(C)C(=O)N2C
Synonym caffeine,1,3,7-trimethylxanthine,guaranine,thein,cafeina,methyltheobromine,koffein,mateina,theine,alert-pep
InChI Key RYYVLZVUVIJVGH-UHFFFAOYSA-N
Molecular Formula C8H10N4O2