(2E)-N-[(4-bromophenyl)methyl]-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide

Systemtic Name: (2E)-N-[(4-bromophenyl)methyl]-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide Openeye Name: (2E)-N-[(4-bromophenyl)methyl]-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide CAS Name: (2E)-N-[(4-bromophenyl)methyl]-2-(1,2-dihydroindazol-3-ylidene)-5-benzimidazolecarboxamide IUPAC Name: (2E)-N-[(4-bromophenyl)methyl]-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide Traditional Name: (2E)-N-(4-bromobenzyl)-2-indazolin-3-ylidene-benzimidazole-5-carboxamide Formula: C22H16BrN5O MolecularWeight: 446.29934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3N=C4C=CC(=CC4=N3)C(=O)NCC5=CC=C(C=C5)Br)NN2

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C\3/N=C4C=CC(=CC4=N3)C(=O)NCC5=CC=C(C=C5)Br)/NN2

InChI

InChI=1S/C22H16BrN5O/c23-15-8-5-13(6-9-15)12-24-22(29)14-7-10-18-19(11-14)26-21(25-18)20-16-3-1-2-4-17(16)27-28-20/h1-11,27-28H,12H2,(H,24,29)/b21-20+