3-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3,4-dichlorophenyl)propanamide

Systemtic Name: 3-[3-cyano-4-(4-methoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3,4-dichlorophenyl)propanamide Openeye Name: 3-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(3,4-dichlorophenyl)propanamide CAS Name: 3-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(3,4-dichlorophenyl)propanamide IUPAC Name: 3-[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(3,4-dichlorophenyl)propanamide Traditional Name: 3-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(3,4-dichlorophenyl)propionamide Formula: C28H21Cl2N3O2S MolecularWeight: 534.45624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

InChI

InChI=1S/C28H21Cl2N3O2S/c1-35-21-10-7-18(8-11-21)22-16-26(19-5-3-2-4-6-19)33-28(23(22)17-31)36-14-13-27(34)32-20-9-12-24(29)25(30)15-20/h2-12,15-16H,13-14H2,1H3,(H,32,34)