4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)benzamide

Systemtic Name: 4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)benzamide Openeye Name: 4-[(3-chloro-N-methylsulfonyl-anilino)methyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)benzamide CAS Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)benzamide IUPAC Name: 4-[(3-chloro-N-methylsulfonylanilino)methyl]-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide Traditional Name: 4-[(3-chloro-N-mesyl-anilino)methyl]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)benzamide Formula: C26H25ClN4O4S MolecularWeight: 525.0191

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN(C4=CC(=CC=C4)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN(C4=CC(=CC=C4)Cl)S(=O)(=O)C

InChI

InChI=1S/C26H25ClN4O4S/c1-18-24(26(33)31(29(18)2)22-9-5-4-6-10-22)28-25(32)20-14-12-19(13-15-20)17-30(36(3,34)35)23-11-7-8-21(27)16-23/h4-16H,17H2,1-3H3,(H,28,32)