ethyl 2-azanyl-6-(2-azanylidene-4-methyl-5-oxidanylidene-1-phenyl-pyrrol-3-yl)-3-cyano-pyridine-4-carboxylate

Systemtic Name: ethyl 2-azanyl-6-(2-azanylidene-4-methyl-5-oxidanylidene-1-phenyl-pyrrol-3-yl)-3-cyano-pyridine-4-carboxylate Openeye Name: ethyl 2-amino-3-cyano-6-(2-imino-4-methyl-5-oxo-1-phenyl-pyrrol-3-yl)pyridine-4-carboxylate CAS Name: 2-amino-3-cyano-6-(2-imino-4-methyl-5-oxo-1-phenyl-3-pyrrolyl)-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-3-cyano-6-(2-imino-4-methyl-5-oxo-1-phenylpyrrol-3-yl)pyridine-4-carboxylate Traditional Name: 2-amino-3-cyano-6-(2-imino-5-keto-4-methyl-1-phenyl-3-pyrrolin-3-yl)isonicotinic acid ethyl ester Formula: C20H17N5O3 MolecularWeight: 375.38068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N5O3/c1-3-28-20(27)13-9-15(24-17(22)14(13)10-21)16-11(2)19(26)25(18(16)23)12-7-5-4-6-8-12/h4-9,23H,3H2,1-2H3,(H2,22,24)