(2-methylsulfanylpyridin-3-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (2-methylsulfanylpyridin-3-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(2-methylsulfanyl-3-pyridyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-[2-(methylthio)-3-pyridinyl]methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Traditional Name: (4-besylpiperazino)-[2-(methylthio)-3-pyridyl]methanone Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H19N3O3S2/c1-24-16-15(8-5-9-18-16)17(21)19-10-12-20(13-11-19)25(22,23)14-6-3-2-4-7-14/h2-9H,10-13H2,1H3