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

Systemtic Name: 1-[4-[4-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(1-tosylisonipecotoyl)piperazino]phenyl]ethanone Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C25H31N3O4S/c1-19-3-9-24(10-4-19)33(31,32)28-13-11-22(12-14-28)25(30)27-17-15-26(16-18-27)23-7-5-21(6-8-23)20(2)29/h3-10,22H,11-18H2,1-2H3