1-[4-[4-[4-(2-methylphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-[4-(2-methylphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[[4-[4-(o-tolyl)piperazine-1-carbonyl]-1-piperidyl]sulfonyl]phenyl]ethanone CAS Name: 1-[4-[[4-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[4-(2-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-[4-(o-tolyl)piperazine-1-carbonyl]piperidino]sulfonylphenyl]ethanone Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

InChI

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