3-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)propanamide

Systemtic Name: 3-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)propanamide Openeye Name: 3-[(3-cyano-4,6-diphenyl-2-pyridyl)sulfanyl]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide CAS Name: 3-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide IUPAC Name: 3-(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide Traditional Name: 3-[(3-cyano-4,6-diphenyl-2-pyridyl)thio]-N-(5-keto-1-phenyl-3-pyrazolin-3-yl)propionamide Formula: C30H23N5O2S MolecularWeight: 517.60092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H23N5O2S/c31-20-25-24(21-10-4-1-5-11-21)18-26(22-12-6-2-7-13-22)32-30(25)38-17-16-28(36)33-27-19-29(37)35(34-27)23-14-8-3-9-15-23/h1-15,18-19,34H,16-17H2,(H,33,36)