(2-chloranyl-5-methylsulfanyl-phenyl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-chloranyl-5-methylsulfanyl-phenyl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(2-chloro-5-methylsulfanyl-phenyl)methanone CAS Name: [2-chloro-5-(methylthio)phenyl]-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(2-chloro-5-methylsulfanylphenyl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-[2-chloro-5-(methylthio)phenyl]methanone Formula: C19H21ClN2O3S2 MolecularWeight: 424.96464

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H21ClN2O3S2/c1-26-16-7-8-18(20)17(13-16)19(23)21-9-11-22(12-10-21)27(24,25)14-15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3