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

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-phenyl-ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-phenyl-acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-phenylacetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phenylacetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-phenyl-acetamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C27H26N4O3S/c1-18-24(27(34)31(30(18)3)22-12-8-5-9-13-22)29-26(33)25(20-10-6-4-7-11-20)35-23-16-14-21(15-17-23)28-19(2)32/h4-17,25H,1-3H3,(H,28,32)(H,29,33)