1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-[(4-methylsulfanylphenyl)methylsulfanyl]ethanone

Systemtic Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-[(4-methylsulfanylphenyl)methylsulfanyl]ethanone Openeye Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-[(4-methylsulfanylphenyl)methylsulfanyl]ethanone CAS Name: 1-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-[[4-(methylthio)phenyl]methylthio]ethanone IUPAC Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-[(4-methylsulfanylphenyl)methylsulfanyl]ethanone Traditional Name: 1-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-2-[[4-(methylthio)benzyl]thio]ethanone Formula: C22H28N2O3S3 MolecularWeight: 464.66432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)SC)C

InChI

InChI=1S/C22H28N2O3S3/c1-17-4-9-21(18(2)14-17)30(26,27)24-12-10-23(11-13-24)22(25)16-29-15-19-5-7-20(28-3)8-6-19/h4-9,14H,10-13,15-16H2,1-3H3