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

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-phenyl-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide Openeye Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-phenyl-acetamide CAS Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-phenylacetamide IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-phenylacetamide Traditional Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-phenyl-acetamide Formula: C31H28N4O4S2 MolecularWeight: 584.70842

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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)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H28N4O4S2/c1-22-28(31(37)35(34(22)2)25-14-8-4-9-15-25)32-30(36)29(23-12-6-3-7-13-23)40-26-20-18-24(19-21-26)33-41(38,39)27-16-10-5-11-17-27/h3-21,29,33H,1-2H3,(H,32,36)