1-[4-[4-[1-(phenylmethyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[1-(phenylmethyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(1-benzylsulfonylpiperidine-4-carbonyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[oxo-[1-(phenylmethyl)sulfonyl-4-piperidinyl]methyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(1-benzylsulfonylpiperidine-4-carbonyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(1-benzylsulfonylisonipecotoyl)piperazino]phenyl]ethanone Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c1-20(29)22-7-9-24(10-8-22)26-15-17-27(18-16-26)25(30)23-11-13-28(14-12-23)33(31,32)19-21-5-3-2-4-6-21/h2-10,23H,11-19H2,1H3