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

Systemtic Name: 4-[(2E)-2-[1-cyano-2-(heptylamino)-2-oxidanylidene-ethylidene]hydrazinyl]-N-methyl-1H-imidazole-5-carboxamide Openeye Name: (1E)-2-(heptylamino)-N-[[5-(methylcarbamoyl)-1H-imidazol-4-yl]amino]-2-oxo-acetimidoyl cyanide CAS Name: 4-[(2E)-2-[1-cyano-2-(heptylamino)-2-oxoethylidene]hydrazinyl]-N-methyl-1H-imidazole-5-carboxamide IUPAC Name: (1E)-2-(heptylamino)-N-[[5-(methylcarbamoyl)-1H-imidazol-4-yl]amino]-2-oxoethanimidoyl cyanide Traditional Name: 4-[(N'E)-N'-[1-cyano-2-(heptylamino)-2-keto-ethylidene]hydrazino]-N-methyl-1H-imidazole-5-carboxamide Formula: C15H23N7O2 MolecularWeight: 333.38882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N7O2/c1-3-4-5-6-7-8-18-14(23)11(9-16)21-22-13-12(15(24)17-2)19-10-20-13/h10,22H,3-8H2,1-2H3,(H,17,24)(H,18,23)(H,19,20)/b21-11+