ethyl 2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(3-cyano-4,6-diphenyl-2-pyridyl)sulfanyl]-3-oxo-butanoate CAS Name: 2-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl-3-oxobutanoate Traditional Name: 2-[(3-cyano-4,6-diphenyl-2-pyridyl)thio]-3-keto-butyric acid ethyl ester Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)SC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)C(C(=O)C)SC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C24H20N2O3S/c1-3-29-24(28)22(16(2)27)30-23-20(15-25)19(17-10-6-4-7-11-17)14-21(26-23)18-12-8-5-9-13-18/h4-14,22H,3H2,1-2H3