3-(4-methylphenyl)sulfonyl-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(4-methylphenyl)sulfonyl-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(p-tolylsulfonyl)-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-methylphenyl)sulfonyl-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-methylphenyl)sulfonyl-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 1-[4-(2-pyridyl)piperazino]-3-tosyl-propan-1-one Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C19H23N3O3S/c1-16-5-7-17(8-6-16)26(24,25)15-9-19(23)22-13-11-21(12-14-22)18-4-2-3-10-20-18/h2-8,10H,9,11-15H2,1H3