4-[(2E)-2-(1-cyano-2-oxidanylidene-2-phenylazanyl-ethylidene)hydrazinyl]-1H-imidazole-5-carboxamide

Systemtic Name: 4-[(2E)-2-(1-cyano-2-oxidanylidene-2-phenylazanyl-ethylidene)hydrazinyl]-1H-imidazole-5-carboxamide Openeye Name: (1E)-2-anilino-N-[(5-carbamoyl-1H-imidazol-4-yl)amino]-2-oxo-acetimidoyl cyanide CAS Name: 4-[(2E)-2-(2-anilino-1-cyano-2-oxoethylidene)hydrazinyl]-1H-imidazole-5-carboxamide IUPAC Name: (1E)-2-anilino-N-[(5-carbamoyl-1H-imidazol-4-yl)amino]-2-oxoethanimidoyl cyanide Traditional Name: 4-[(N'E)-N'-(2-anilino-1-cyano-2-keto-ethylidene)hydrazino]-1H-imidazole-5-carboxamide Formula: C13H11N7O2 MolecularWeight: 297.27214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(=NNC2=C(NC=N2)C(=O)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)/C(=N/NC2=C(NC=N2)C(=O)N)/C#N

InChI

InChI=1S/C13H11N7O2/c14-6-9(13(22)18-8-4-2-1-3-5-8)19-20-12-10(11(15)21)16-7-17-12/h1-5,7,20H,(H2,15,21)(H,16,17)(H,18,22)/b19-9+