1-[4-[(2Z)-2-(5-bromanyl-1,2-dihydroindazol-3-ylidene)benzimidazol-5-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[(2Z)-2-(5-bromanyl-1,2-dihydroindazol-3-ylidene)benzimidazol-5-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[(2Z)-2-(5-bromo-1,2-dihydroindazol-3-ylidene)benzimidazol-5-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[(2Z)-2-(5-bromo-1,2-dihydroindazol-3-ylidene)-5-benzimidazolyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[(2Z)-2-(5-bromo-1,2-dihydroindazol-3-ylidene)benzimidazol-5-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[(2Z)-2-(5-bromoindazolin-3-ylidene)benzimidazol-5-yl]piperazino]ethanone Formula: C20H19BrN6O MolecularWeight: 439.30846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC3=NC(=C4C5=C(C=CC(=C5)Br)NN4)N=C3C=C2

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC3=N/C(=C\4/C5=C(C=CC(=C5)Br)NN4)/N=C3C=C2

InChI

InChI=1S/C20H19BrN6O/c1-12(28)26-6-8-27(9-7-26)14-3-5-17-18(11-14)23-20(22-17)19-15-10-13(21)2-4-16(15)24-25-19/h2-5,10-11,24-25H,6-9H2,1H3/b20-19-