4-(4-butoxyphenyl)-5-cyano-2-methyl-6-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 4-(4-butoxyphenyl)-5-cyano-2-methyl-6-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 4-(4-butoxyphenyl)-5-cyano-2-methyl-6-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-N-phenyl-pyridine-3-carboxamide CAS Name: 4-(4-butoxyphenyl)-5-cyano-2-methyl-6-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-N-phenyl-3-pyridinecarboxamide IUPAC Name: 4-(4-butoxyphenyl)-5-cyano-2-methyl-6-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-N-phenylpyridine-3-carboxamide Traditional Name: 4-(4-butoxyphenyl)-5-cyano-6-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-2-methyl-N-phenyl-nicotinamide Formula: C38H33N3O3S MolecularWeight: 611.75192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C38H33N3O3S/c1-3-4-23-44-32-21-19-30(20-22-32)36-33(24-39)38(40-26(2)35(36)37(43)41-31-13-9-6-10-14-31)45-25-34(42)29-17-15-28(16-18-29)27-11-7-5-8-12-27/h5-22H,3-4,23,25H2,1-2H3,(H,41,43)