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

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-7-phenyl-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-7-phenyl-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-7-phenyl-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-7-phenyl-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-7-phenyl-1H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1C3=CC=CC=C3)NC=NC2=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1C3=CC=CC=C3)NC=NC2=O)C

InChI

InChI=1S/C16H15N3O3/c1-3-22-16(21)13-10(2)12-14(17-9-18-15(12)20)19(13)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H,17,18,20)