5-[4-(4-bromophenyl)carbonylpiperazin-1-yl]sulfonyl-1,3-dimethyl-benzimidazol-2-one

Systemtic Name: 5-[4-(4-bromophenyl)carbonylpiperazin-1-yl]sulfonyl-1,3-dimethyl-benzimidazol-2-one Openeye Name: 5-[4-(4-bromobenzoyl)piperazin-1-yl]sulfonyl-1,3-dimethyl-benzimidazol-2-one CAS Name: 5-[[4-[(4-bromophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]-1,3-dimethyl-2-benzimidazolone IUPAC Name: 5-[4-(4-bromobenzoyl)piperazin-1-yl]sulfonyl-1,3-dimethylbenzimidazol-2-one Traditional Name: 5-[4-(4-bromobenzoyl)piperazino]sulfonyl-1,3-dimethyl-benzimidazol-2-one Formula: C20H21BrN4O4S MolecularWeight: 493.37414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)Br)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)Br)N(C1=O)C

InChI

InChI=1S/C20H21BrN4O4S/c1-22-17-8-7-16(13-18(17)23(2)20(22)27)30(28,29)25-11-9-24(10-12-25)19(26)14-3-5-15(21)6-4-14/h3-8,13H,9-12H2,1-2H3