2-(1-methylbenzimidazol-2-yl)sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(1-methylbenzimidazol-2-yl)sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 2-[(1-methyl-2-benzimidazolyl)thio]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[(1-methylbenzimidazol-2-yl)thio]ethanone Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O3S2/c1-23-19-10-6-5-9-18(19)22-21(23)29-15-20(26)24-11-13-25(14-12-24)30(27,28)16-17-7-3-2-4-8-17/h2-10H,11-16H2,1H3