1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanone

Systemtic Name: 1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(2-isopropylsulfanylbenzimidazol-1-yl)ethanone CAS Name: 1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-2-[2-(propan-2-ylthio)-1-benzimidazolyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[2-(isopropylthio)benzimidazol-1-yl]ethanone Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)SC1=NC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O3S2/c1-18(2)31-23-24-20-10-6-7-11-21(20)27(23)16-22(28)25-12-14-26(15-13-25)32(29,30)17-19-8-4-3-5-9-19/h3-11,18H,12-17H2,1-2H3