N-[2-methylsulfanyl-5-[5-(4-phenylpiperazin-1-yl)pentanoyl]phenyl]ethanesulfonamide

Systemtic Name: N-[2-methylsulfanyl-5-[5-(4-phenylpiperazin-1-yl)pentanoyl]phenyl]ethanesulfonamide Openeye Name: N-[2-methylsulfanyl-5-[5-(4-phenylpiperazin-1-yl)pentanoyl]phenyl]ethanesulfonamide CAS Name: N-[2-(methylthio)-5-[1-oxo-5-(4-phenyl-1-piperazinyl)pentyl]phenyl]ethanesulfonamide IUPAC Name: N-[2-methylsulfanyl-5-[5-(4-phenylpiperazin-1-yl)pentanoyl]phenyl]ethanesulfonamide Traditional Name: N-[2-(methylthio)-5-[5-(4-phenylpiperazino)pentanoyl]phenyl]ethanesulfonamide Formula: C24H33N3O3S2 MolecularWeight: 475.66712

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=C(C=CC(=C1)C(=O)CCCCN2CCN(CC2)C3=CC=CC=C3)SC

Isomeric SMILES

CCS(=O)(=O)NC1=C(C=CC(=C1)C(=O)CCCCN2CCN(CC2)C3=CC=CC=C3)SC

InChI

InChI=1S/C24H33N3O3S2/c1-3-32(29,30)25-22-19-20(12-13-24(22)31-2)23(28)11-7-8-14-26-15-17-27(18-16-26)21-9-5-4-6-10-21/h4-6,9-10,12-13,19,25H,3,7-8,11,14-18H2,1-2H3