1-[4-[4-(3-methylphenyl)piperazin-1-yl]sulfonylphenyl]piperidin-2-one

Systemtic Name: 1-[4-[4-(3-methylphenyl)piperazin-1-yl]sulfonylphenyl]piperidin-2-one Openeye Name: 1-[4-[4-(m-tolyl)piperazin-1-yl]sulfonylphenyl]piperidin-2-one CAS Name: 1-[4-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]phenyl]-2-piperidinone IUPAC Name: 1-[4-[4-(3-methylphenyl)piperazin-1-yl]sulfonylphenyl]piperidin-2-one Traditional Name: 1-[4-[4-(m-tolyl)piperazino]sulfonylphenyl]-2-piperidone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N4CCCCC4=O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N4CCCCC4=O

InChI

InChI=1S/C22H27N3O3S/c1-18-5-4-6-20(17-18)23-13-15-24(16-14-23)29(27,28)21-10-8-19(9-11-21)25-12-3-2-7-22(25)26/h4-6,8-11,17H,2-3,7,12-16H2,1H3