2-(2-methylphenyl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(2-methylphenyl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(o-tolyl)-1-[4-(3-pyridylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(2-methylphenyl)-1-[4-(3-pyridinylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-methylphenyl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(o-tolyl)-1-[4-(3-pyridylsulfonyl)piperazino]ethanone Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H21N3O3S/c1-15-5-2-3-6-16(15)13-18(22)20-9-11-21(12-10-20)25(23,24)17-7-4-8-19-14-17/h2-8,14H,9-13H2,1H3