(2E)-N-(2-cyanoethyl)-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide

Systemtic Name: (2E)-N-(2-cyanoethyl)-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide Openeye Name: (2E)-N-(2-cyanoethyl)-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide CAS Name: (2E)-N-(2-cyanoethyl)-2-(1,2-dihydroindazol-3-ylidene)-5-benzimidazolecarboxamide IUPAC Name: (2E)-N-(2-cyanoethyl)-2-(1,2-dihydroindazol-3-ylidene)benzimidazole-5-carboxamide Traditional Name: (2E)-N-(2-cyanoethyl)-2-indazolin-3-ylidene-benzimidazole-5-carboxamide Formula: C18H14N6O MolecularWeight: 330.34336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3N=C4C=CC(=CC4=N3)C(=O)NCCC#N)NN2

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C\3/N=C4C=CC(=CC4=N3)C(=O)NCCC#N)/NN2

InChI

InChI=1S/C18H14N6O/c19-8-3-9-20-18(25)11-6-7-14-15(10-11)22-17(21-14)16-12-4-1-2-5-13(12)23-24-16/h1-2,4-7,10,23-24H,3,9H2,(H,20,25)/b17-16+