ethyl (2E)-5-azanyl-8-cyano-3-oxidanylidene-7-phenyl-2-(phenylmethylidene)-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate

Systemtic Name: ethyl (2E)-5-azanyl-8-cyano-3-oxidanylidene-7-phenyl-2-(phenylmethylidene)-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate Openeye Name: ethyl (2E)-5-amino-2-benzylidene-8-cyano-3-oxo-7-phenyl-7H-thiazolo[3,2-a]pyridine-6-carboxylate CAS Name: (2E)-5-amino-8-cyano-3-oxo-7-phenyl-2-(phenylmethylene)-7H-thiazolo[3,2-a]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2E)-5-amino-2-benzylidene-8-cyano-3-oxo-7-phenyl-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate Traditional Name: (2E)-5-amino-2-benzal-8-cyano-3-keto-7-phenyl-7H-thiazolo[3,2-a]pyridine-6-carboxylic acid ethyl ester Formula: C24H19N3O3S MolecularWeight: 429.49096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C(=C(C1C3=CC=CC=C3)C#N)SC(=CC4=CC=CC=C4)C2=O)N

Isomeric SMILES

CCOC(=O)C1=C(N2C(=C(C1C3=CC=CC=C3)C#N)S/C(=C/C4=CC=CC=C4)/C2=O)N

InChI

InChI=1S/C24H19N3O3S/c1-2-30-24(29)20-19(16-11-7-4-8-12-16)17(14-25)23-27(21(20)26)22(28)18(31-23)13-15-9-5-3-6-10-15/h3-13,19H,2,26H2,1H3/b18-13+