4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethoxy]-N-isopropyl-benzenesulfonamide CAS Name: 4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethoxy]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethoxy]-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethoxy]-N-isopropyl-benzenesulfonamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O4S/c1-18(2)23-30(27,28)21-10-8-20(9-11-21)29-17-22(26)25-14-12-24(13-15-25)16-19-6-4-3-5-7-19/h3-11,18,23H,12-17H2,1-2H3