2-(benzimidazol-1-yl)-1-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-(benzimidazol-1-yl)-1-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 2-(benzimidazol-1-yl)-1-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 2-(1-benzimidazolyl)-1-[4-(2-bromophenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 2-(benzimidazol-1-yl)-1-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 2-(benzimidazol-1-yl)-1-[4-(2-bromophenyl)sulfonylpiperazino]propan-1-one Formula: C20H21BrN4O3S MolecularWeight: 477.37474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Br)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Br)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C20H21BrN4O3S/c1-15(25-14-22-17-7-3-4-8-18(17)25)20(26)23-10-12-24(13-11-23)29(27,28)19-9-5-2-6-16(19)21/h2-9,14-15H,10-13H2,1H3