1-[3-(1H-benzimidazol-2-yl)-5-(4-bromophenyl)-1,3-dihydropyrazol-2-yl]-2-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 1-[3-(1H-benzimidazol-2-yl)-5-(4-bromophenyl)-1,3-dihydropyrazol-2-yl]-2-(4-methylpiperazin-1-yl)ethanone Openeye Name: 1-[3-(1H-benzimidazol-2-yl)-5-(4-bromophenyl)-1,3-dihydropyrazol-2-yl]-2-(4-methylpiperazin-1-yl)ethanone CAS Name: 1-[3-(1H-benzimidazol-2-yl)-5-(4-bromophenyl)-1,3-dihydropyrazol-2-yl]-2-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 1-[3-(1H-benzimidazol-2-yl)-5-(4-bromophenyl)-1,3-dihydropyrazol-2-yl]-2-(4-methylpiperazin-1-yl)ethanone Traditional Name: 1-[5-(1H-benzimidazol-2-yl)-3-(4-bromophenyl)-3-pyrazolin-1-yl]-2-(4-methylpiperazino)ethanone Formula: C23H25BrN6O MolecularWeight: 481.3882

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)N2C(C=C(N2)C3=CC=C(C=C3)Br)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CN1CCN(CC1)CC(=O)N2C(C=C(N2)C3=CC=C(C=C3)Br)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C23H25BrN6O/c1-28-10-12-29(13-11-28)15-22(31)30-21(23-25-18-4-2-3-5-19(18)26-23)14-20(27-30)16-6-8-17(24)9-7-16/h2-9,14,21,27H,10-13,15H2,1H3,(H,25,26)