N-[2-methylsulfanyl-5-[1-oxidanyl-6-(4-phenylpiperazin-1-yl)hexyl]phenyl]methanesulfonamide

Systemtic Name: N-[2-methylsulfanyl-5-[1-oxidanyl-6-(4-phenylpiperazin-1-yl)hexyl]phenyl]methanesulfonamide Openeye Name: N-[5-[1-hydroxy-6-(4-phenylpiperazin-1-yl)hexyl]-2-methylsulfanyl-phenyl]methanesulfonamide CAS Name: N-[5-[1-hydroxy-6-(4-phenyl-1-piperazinyl)hexyl]-2-(methylthio)phenyl]methanesulfonamide IUPAC Name: N-[5-[1-hydroxy-6-(4-phenylpiperazin-1-yl)hexyl]-2-methylsulfanylphenyl]methanesulfonamide Traditional Name: N-[5-[1-hydroxy-6-(4-phenylpiperazino)hexyl]-2-(methylthio)phenyl]methanesulfonamide Formula: C24H35N3O3S2 MolecularWeight: 477.683

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(CCCCCN2CCN(CC2)C3=CC=CC=C3)O)NS(=O)(=O)C

Isomeric SMILES

CSC1=C(C=C(C=C1)C(CCCCCN2CCN(CC2)C3=CC=CC=C3)O)NS(=O)(=O)C

InChI

InChI=1S/C24H35N3O3S2/c1-31-24-13-12-20(19-22(24)25-32(2,29)30)23(28)11-7-4-8-14-26-15-17-27(18-16-26)21-9-5-3-6-10-21/h3,5-6,9-10,12-13,19,23,25,28H,4,7-8,11,14-18H2,1-2H3