2-(4-acetamidophenyl)sulfanyl-N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)-2-phenyl-ethanamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)-2-phenyl-ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-phenyl-acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-phenylacetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)-2-phenylacetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-(5-keto-1-phenyl-2-pyrazolin-3-yl)-2-phenyl-acetamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC(C2=CC=CC=C2)C(=O)NC3=NN(C(=O)C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC(C2=CC=CC=C2)C(=O)NC3=NN(C(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O3S/c1-17(30)26-19-12-14-21(15-13-19)33-24(18-8-4-2-5-9-18)25(32)27-22-16-23(31)29(28-22)20-10-6-3-7-11-20/h2-15,24H,16H2,1H3,(H,26,30)(H,27,28,32)