3-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide

Systemtic Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide Openeye Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(4-isopropylphenyl)propanamide CAS Name: 3-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]thio]-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide Traditional Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]thio]-N-p-cumenyl-propionamide Formula: C31H29N3OS MolecularWeight: 491.64646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)C(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)C(C)C)C4=CC=CC=C4

InChI

InChI=1S/C31H29N3OS/c1-21(2)23-13-15-26(16-14-23)33-30(35)17-18-36-31-28(20-32)27(24-11-9-22(3)10-12-24)19-29(34-31)25-7-5-4-6-8-25/h4-16,19,21H,17-18H2,1-3H3,(H,33,35)