N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-(2-methylpropyl)benzenesulfonamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-(2-methylpropyl)benzenesulfonamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-isobutyl-benzenesulfonamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-(2-methylpropyl)benzenesulfonamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-(2-methylpropyl)benzenesulfonamide Traditional Name: 4-isobutyl-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)benzenesulfonamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)CC(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)CC(C)C

InChI

InChI=1S/C21H25N3O3S/c1-15(2)14-17-10-12-19(13-11-17)28(26,27)22-20-16(3)23(4)24(21(20)25)18-8-6-5-7-9-18/h5-13,15,22H,14H2,1-4H3