N-(3,4-dimethylphenyl)-4-(4-phenylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-(4-phenylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(3,4-dimethylphenyl)-4-(4-phenylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-(3,4-dimethylphenyl)-4-[oxo-(4-phenyl-1-piperazinyl)methyl]benzenesulfonamide IUPAC Name: N-(3,4-dimethylphenyl)-4-(4-phenylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: N-(3,4-dimethylphenyl)-4-(4-phenylpiperazine-1-carbonyl)benzenesulfonamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H27N3O3S/c1-19-8-11-22(18-20(19)2)26-32(30,31)24-12-9-21(10-13-24)25(29)28-16-14-27(15-17-28)23-6-4-3-5-7-23/h3-13,18,26H,14-17H2,1-2H3