2,5-dimethyl-N-[[4-(4-phenylpiperazin-1-yl)carbonylphenyl]methyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[[4-(4-phenylpiperazin-1-yl)carbonylphenyl]methyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[[4-(4-phenylpiperazine-1-carbonyl)phenyl]methyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[[4-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[[4-(4-phenylpiperazine-1-carbonyl)phenyl]methyl]benzenesulfonamide Traditional Name: 2,5-dimethyl-N-[4-(4-phenylpiperazine-1-carbonyl)benzyl]benzenesulfonamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S/c1-20-8-9-21(2)25(18-20)33(31,32)27-19-22-10-12-23(13-11-22)26(30)29-16-14-28(15-17-29)24-6-4-3-5-7-24/h3-13,18,27H,14-17,19H2,1-2H3