[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl] 5-methylimidazo[1,2-a]pyridine-2-carboxylate

Systemtic Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl] 5-methylimidazo[1,2-a]pyridine-2-carboxylate Openeye Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxo-propyl] 5-methylimidazo[1,2-a]pyridine-2-carboxylate CAS Name: 5-methyl-2-imidazo[1,2-a]pyridinecarboxylic acid [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl] ester IUPAC Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl] 5-methylimidazo[1,2-a]pyridine-2-carboxylate Traditional Name: 5-methylimidazo[1,2-a]pyridine-2-carboxylic acid [(3E)-3-cyano-2-keto-3-(3-methyl-1H-benzimidazol-2-ylidene)propyl] ester Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CN12)C(=O)OCC(=O)C(=C3NC4=CC=CC=C4N3C)C#N

Isomeric SMILES

CC1=CC=CC2=NC(=CN12)C(=O)OCC(=O)/C(=C/3\NC4=CC=CC=C4N3C)/C#N

InChI

InChI=1S/C21H17N5O3/c1-13-6-5-9-19-23-16(11-26(13)19)21(28)29-12-18(27)14(10-22)20-24-15-7-3-4-8-17(15)25(20)2/h3-9,11,24H,12H2,1-2H3/b20-14+