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

Systemtic Name: 2-(2-butylbenzimidazol-1-yl)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(2-butylbenzimidazol-1-yl)ethanone CAS Name: 2-(2-butyl-1-benzimidazolyl)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(2-butylbenzimidazol-1-yl)ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(2-butylbenzimidazol-1-yl)ethanone Formula: C24H30N4O3S MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H30N4O3S/c1-2-3-13-23-25-21-11-7-8-12-22(21)28(23)18-24(29)26-14-16-27(17-15-26)32(30,31)19-20-9-5-4-6-10-20/h4-12H,2-3,13-19H2,1H3