(2-chloranyl-5-methylsulfanyl-phenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (2-chloranyl-5-methylsulfanyl-phenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (2-chloro-5-methylsulfanyl-phenyl)-[4-(3-pyridylsulfonyl)piperazin-1-yl]methanone CAS Name: [2-chloro-5-(methylthio)phenyl]-[4-(3-pyridinylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (2-chloro-5-methylsulfanylphenyl)-(4-pyridin-3-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [2-chloro-5-(methylthio)phenyl]-[4-(3-pyridylsulfonyl)piperazino]methanone Formula: C17H18ClN3O3S2 MolecularWeight: 411.92612

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H18ClN3O3S2/c1-25-13-4-5-16(18)15(11-13)17(22)20-7-9-21(10-8-20)26(23,24)14-3-2-6-19-12-14/h2-6,11-12H,7-10H2,1H3