2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]ethanone Formula: C24H28N4O3S2 MolecularWeight: 484.63412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C24H28N4O3S2/c1-19-14-20(2)16-22(15-19)28-9-8-25-24(28)32-17-23(29)26-10-12-27(13-11-26)33(30,31)18-21-6-4-3-5-7-21/h3-9,14-16H,10-13,17-18H2,1-2H3