5-cyano-4-(4-methoxyphenyl)-2-methyl-6-phenacylsulfanyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-6-phenacylsulfanyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-6-phenacylsulfanyl-N-phenyl-pyridine-3-carboxamide CAS Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-6-(phenacylthio)-N-phenyl-3-pyridinecarboxamide IUPAC Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-6-phenacylsulfanyl-N-phenylpyridine-3-carboxamide Traditional Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-6-(phenacylthio)-N-phenyl-nicotinamide Formula: C29H23N3O3S MolecularWeight: 493.57622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=C(C=C3)OC)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(C(=N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=C(C=C3)OC)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C29H23N3O3S/c1-19-26(28(34)32-22-11-7-4-8-12-22)27(21-13-15-23(35-2)16-14-21)24(17-30)29(31-19)36-18-25(33)20-9-5-3-6-10-20/h3-16H,18H2,1-2H3,(H,32,34)