1-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]-4-(2-methylsulfanylphenyl)piperazine

Systemtic Name: 1-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]-4-(2-methylsulfanylphenyl)piperazine Openeye Name: 1-(2-methylsulfanylphenyl)-4-[[1-(p-tolylsulfonyl)pyrrol-2-yl]methyl]piperazine CAS Name: 1-[[1-(4-methylphenyl)sulfonyl-2-pyrrolyl]methyl]-4-[2-(methylthio)phenyl]piperazine IUPAC Name: 1-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]-4-(2-methylsulfanylphenyl)piperazine Traditional Name: 1-[2-(methylthio)phenyl]-4-[(1-tosylpyrrol-2-yl)methyl]piperazine Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2CN3CCN(CC3)C4=CC=CC=C4SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2CN3CCN(CC3)C4=CC=CC=C4SC

InChI

InChI=1S/C23H27N3O2S2/c1-19-9-11-21(12-10-19)30(27,28)26-13-5-6-20(26)18-24-14-16-25(17-15-24)22-7-3-4-8-23(22)29-2/h3-13H,14-18H2,1-2H3