2-[(3-chloranyl-4-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide Openeye Name: 2-[3-chloro-4-methyl-N-(p-tolylsulfonyl)anilino]-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)acetamide CAS Name: 2-(3-chloro-4-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)acetamide IUPAC Name: 2-(3-chloro-4-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide Traditional Name: 2-(3-chloro-4-methyl-N-tosyl-anilino)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide Formula: C27H27ClN4O4S MolecularWeight: 539.04568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=CC(=C(C=C4)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C4=CC(=C(C=C4)C)Cl

InChI

InChI=1S/C27H27ClN4O4S/c1-18-10-14-23(15-11-18)37(35,36)31(22-13-12-19(2)24(28)16-22)17-25(33)29-26-20(3)30(4)32(27(26)34)21-8-6-5-7-9-21/h5-16H,17H2,1-4H3,(H,29,33)