3-chloranyl-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]-N-(1-phenylethyl)benzenesulfonamide

Systemtic Name: 3-chloranyl-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]-N-(1-phenylethyl)benzenesulfonamide Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethoxy]-3-chloro-N-(1-phenylethyl)benzenesulfonamide CAS Name: 3-chloro-4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethoxy]-N-(1-phenylethyl)benzenesulfonamide IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethoxy]-3-chloro-N-(1-phenylethyl)benzenesulfonamide Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethoxy]-3-chloro-N-(1-phenylethyl)benzenesulfonamide Formula: C27H30ClN3O4S MolecularWeight: 528.0628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)OCC(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C27H30ClN3O4S/c1-21(23-10-6-3-7-11-23)29-36(33,34)24-12-13-26(25(28)18-24)35-20-27(32)31-16-14-30(15-17-31)19-22-8-4-2-5-9-22/h2-13,18,21,29H,14-17,19-20H2,1H3