N-[3-[4-[3-(1-benzothiophen-3-yl)-3-oxidanyl-propyl]piperazin-1-yl]phenyl]ethanesulfonamide

Systemtic Name: N-[3-[4-[3-(1-benzothiophen-3-yl)-3-oxidanyl-propyl]piperazin-1-yl]phenyl]ethanesulfonamide Openeye Name: N-[3-[4-[3-(benzothiophen-3-yl)-3-hydroxy-propyl]piperazin-1-yl]phenyl]ethanesulfonamide CAS Name: N-[3-[4-[3-(1-benzothiophen-3-yl)-3-hydroxypropyl]-1-piperazinyl]phenyl]ethanesulfonamide IUPAC Name: N-[3-[4-[3-(1-benzothiophen-3-yl)-3-hydroxypropyl]piperazin-1-yl]phenyl]ethanesulfonamide Traditional Name: N-[3-[4-[3-(benzothiophen-3-yl)-3-hydroxy-propyl]piperazino]phenyl]ethanesulfonamide Formula: C23H29N3O3S2 MolecularWeight: 459.62466

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=CC(=C1)N2CCN(CC2)CCC(C3=CSC4=CC=CC=C43)O

Isomeric SMILES

CCS(=O)(=O)NC1=CC=CC(=C1)N2CCN(CC2)CCC(C3=CSC4=CC=CC=C43)O

InChI

InChI=1S/C23H29N3O3S2/c1-2-31(28,29)24-18-6-5-7-19(16-18)26-14-12-25(13-15-26)11-10-22(27)21-17-30-23-9-4-3-8-20(21)23/h3-9,16-17,22,24,27H,2,10-15H2,1H3