(2-methylsulfanylphenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (2-methylsulfanylphenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (2-methylsulfanylphenyl)-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: [2-(methylthio)phenyl]-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (2-methylsulfanylphenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [2-(methylthio)phenyl]-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H22N2O3S2/c1-28-21-9-5-4-8-20(21)22(25)23-12-14-24(15-13-23)29(26,27)19-11-10-17-6-2-3-7-18(17)16-19/h2-11,16H,12-15H2,1H3