2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[1-(3-methylphenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[1-(m-tolyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 2-[[1-(3-methylphenyl)-2-imidazolyl]thio]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[[1-(m-tolyl)imidazol-2-yl]thio]ethanone Formula: C23H26N4O3S2 MolecularWeight: 470.60754

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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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O3S2/c1-19-6-5-9-21(16-19)27-11-10-24-23(27)31-17-22(28)25-12-14-26(15-13-25)32(29,30)18-20-7-3-2-4-8-20/h2-11,16H,12-15,17-18H2,1H3