ethyl 5,6-dimethyl-4-oxidanylidene-7-phenyl-1H-pyrrolo[2,3-d]pyrimidine-2-carboxylate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=O)C2=C(N1)N(C(=C2C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NC(=O)C2=C(N1)N(C(=C2C)C)C3=CC=CC=C3

InChI

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