(2-methylsulfanylphenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2-methylsulfanylphenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-methylsulfanylphenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [2-(methylthio)phenyl]-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-methylsulfanylphenyl)-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [2-(methylthio)phenyl]-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazino]methanone Formula: C22H28N2O3S2 MolecularWeight: 432.59932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SC)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3SC)C)C

InChI

InChI=1S/C22H28N2O3S2/c1-15-14-16(2)18(4)21(17(15)3)29(26,27)24-12-10-23(11-13-24)22(25)19-8-6-7-9-20(19)28-5/h6-9,14H,10-13H2,1-5H3