N-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]-N-phenyl-methanesulfonamide

Systemtic Name: N-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]-N-phenyl-methanesulfonamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)-4-oxo-butyl]-N-phenyl-methanesulfonamide CAS Name: N-[4-oxo-4-[4-(phenylmethyl)-1-piperazinyl]butyl]-N-phenylmethanesulfonamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-N-phenylmethanesulfonamide Traditional Name: N-[4-(4-benzylpiperazino)-4-keto-butyl]-N-phenyl-methanesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)N1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)N1CCN(CC1)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-29(27,28)25(21-11-6-3-7-12-21)14-8-13-22(26)24-17-15-23(16-18-24)19-20-9-4-2-5-10-20/h2-7,9-12H,8,13-19H2,1H3