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

Systemtic Name: 4-[(2E)-2-[1-cyano-2-(heptylamino)-2-oxidanylidene-ethylidene]hydrazinyl]-1H-imidazole-5-carboxamide Openeye Name: (1E)-N-[(5-carbamoyl-1H-imidazol-4-yl)amino]-2-(heptylamino)-2-oxo-acetimidoyl cyanide CAS Name: 4-[(2E)-2-[1-cyano-2-(heptylamino)-2-oxoethylidene]hydrazinyl]-1H-imidazole-5-carboxamide IUPAC Name: (1E)-N-[(5-carbamoyl-1H-imidazol-4-yl)amino]-2-(heptylamino)-2-oxoethanimidoyl cyanide Traditional Name: 4-[(N'E)-N'-[1-cyano-2-(heptylamino)-2-keto-ethylidene]hydrazino]-1H-imidazole-5-carboxamide Formula: C14H21N7O2 MolecularWeight: 319.36224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C(=NNC1=C(NC=N1)C(=O)N)C#N

Isomeric SMILES

CCCCCCCNC(=O)/C(=N/NC1=C(NC=N1)C(=O)N)/C#N

InChI

InChI=1S/C14H21N7O2/c1-2-3-4-5-6-7-17-14(23)10(8-15)20-21-13-11(12(16)22)18-9-19-13/h9,21H,2-7H2,1H3,(H2,16,22)(H,17,23)(H,18,19)/b20-10+