2-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)propanamide

Systemtic Name: 2-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)propanamide Openeye Name: 2-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide CAS Name: 2-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]thio]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide IUPAC Name: 2-[3-cyano-4-(4-methylphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide Traditional Name: 2-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]thio]-N-(5-keto-1-phenyl-3-pyrazolin-3-yl)propionamide Formula: C31H25N5O2S MolecularWeight: 531.6275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SC(C)C(=O)NC3=CC(=O)N(N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SC(C)C(=O)NC3=CC(=O)N(N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H25N5O2S/c1-20-13-15-22(16-14-20)25-17-27(23-9-5-3-6-10-23)33-31(26(25)19-32)39-21(2)30(38)34-28-18-29(37)36(35-28)24-11-7-4-8-12-24/h3-18,21,35H,1-2H3,(H,34,38)