methyl 2-[[4-chloranyl-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-sulfamoyl]phenyl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[4-chloranyl-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-methyl-sulfamoyl]phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-chloro-3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-methyl-sulfamoyl]benzoyl]amino]benzoate CAS Name: 2-[[[4-chloro-3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-methylsulfamoyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-chloro-3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-methylsulfamoyl]benzoyl]amino]benzoate Traditional Name: 2-[[4-chloro-3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-methyl-sulfamoyl]benzoyl]amino]benzoic acid methyl ester Formula: C27H25ClN4O6S MolecularWeight: 569.0286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=CC=C4C(=O)OC)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=CC=C4C(=O)OC)Cl

InChI

InChI=1S/C27H25ClN4O6S/c1-17-24(26(34)32(30(17)2)19-10-6-5-7-11-19)31(3)39(36,37)23-16-18(14-15-21(23)28)25(33)29-22-13-9-8-12-20(22)27(35)38-4/h5-16H,1-4H3,(H,29,33)