2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[[1-(3,4-dimethylphenyl)-2-imidazolyl]thio]ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-besylpiperazino)-2-[[1-(3,4-dimethylphenyl)imidazol-2-yl]thio]ethanone Formula: C23H26N4O3S2 MolecularWeight: 470.60754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=CN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=CN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C23H26N4O3S2/c1-18-8-9-20(16-19(18)2)27-11-10-24-23(27)31-17-22(28)25-12-14-26(15-13-25)32(29,30)21-6-4-3-5-7-21/h3-11,16H,12-15,17H2,1-2H3