N-butyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-butyl-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 3-(4-benzylpiperazine-1-carbonyl)-N-butyl-benzenesulfonamide CAS Name: N-butyl-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: 3-(4-benzylpiperazine-1-carbonyl)-N-butylbenzenesulfonamide Traditional Name: 3-(4-benzylpiperazine-1-carbonyl)-N-butyl-benzenesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-2-3-12-23-29(27,28)21-11-7-10-20(17-21)22(26)25-15-13-24(14-16-25)18-19-8-5-4-6-9-19/h4-11,17,23H,2-3,12-16,18H2,1H3