[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Openeye Name: (2-methylsulfanyl-3-pyridyl)-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[2-(methylthio)-3-pyridinyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Traditional Name: [2-(methylthio)-3-pyridyl]-(4-tosylpiperazino)methanone Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3S2/c1-14-5-7-15(8-6-14)26(23,24)21-12-10-20(11-13-21)18(22)16-4-3-9-19-17(16)25-2/h3-9H,10-13H2,1-2H3