ethyl 6-methyl-7-(4-methylphenyl)-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-methyl-7-(4-methylphenyl)-4-oxidanylidene-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 6-methyl-4-oxo-7-(p-tolyl)-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate CAS Name: 6-methyl-7-(4-methylphenyl)-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-7-(4-methylphenyl)-4-oxo-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-keto-6-methyl-7-(p-tolyl)-1H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=O)N=CN2)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=O)N=CN2)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C17H17N3O3/c1-4-23-17(22)13-11(3)20(12-7-5-10(2)6-8-12)15-14(13)16(21)19-9-18-15/h5-9H,4H2,1-3H3,(H,18,19,21)