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

Systemtic Name: 4-[(2E)-2-[1-cyano-2-[(2-methylphenyl)amino]-2-oxidanylidene-ethylidene]hydrazinyl]-1H-imidazole-5-carboxamide Openeye Name: (1E)-N-[(5-carbamoyl-1H-imidazol-4-yl)amino]-2-(2-methylanilino)-2-oxo-acetimidoyl cyanide CAS Name: 4-[(2E)-2-[1-cyano-2-(2-methylanilino)-2-oxoethylidene]hydrazinyl]-1H-imidazole-5-carboxamide IUPAC Name: (1E)-N-[(5-carbamoyl-1H-imidazol-4-yl)amino]-2-(2-methylanilino)-2-oxoethanimidoyl cyanide Traditional Name: 4-[(N'E)-N'-[1-cyano-2-keto-2-(o-toluidino)ethylidene]hydrazino]-1H-imidazole-5-carboxamide Formula: C14H13N7O2 MolecularWeight: 311.29872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=NNC2=C(NC=N2)C(=O)N)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=N/NC2=C(NC=N2)C(=O)N)/C#N

InChI

InChI=1S/C14H13N7O2/c1-8-4-2-3-5-9(8)19-14(23)10(6-15)20-21-13-11(12(16)22)17-7-18-13/h2-5,7,21H,1H3,(H2,16,22)(H,17,18)(H,19,23)/b20-10+