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

Systemtic Name: N-[3-[4-[3-(1-benzothiophen-3-yl)-3-oxidanyl-propyl]piperazin-1-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[4-[3-(benzothiophen-3-yl)-3-hydroxy-propyl]piperazin-1-yl]phenyl]methanesulfonamide CAS Name: N-[3-[4-[3-(1-benzothiophen-3-yl)-3-hydroxypropyl]-1-piperazinyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[4-[3-(1-benzothiophen-3-yl)-3-hydroxypropyl]piperazin-1-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[4-[3-(benzothiophen-3-yl)-3-hydroxy-propyl]piperazino]phenyl]methanesulfonamide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S2/c1-30(27,28)23-17-5-4-6-18(15-17)25-13-11-24(12-14-25)10-9-21(26)20-16-29-22-8-3-2-7-19(20)22/h2-8,15-16,21,23,26H,9-14H2,1H3