N-(3-azanyl-3-azanylidene-propyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-imidazol-2-yl)carbonylamino]imidazol-2-yl]carbonylamino]imidazole-2-carboxamide

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-imidazol-2-yl)carbonylamino]imidazol-2-yl]carbonylamino]imidazole-2-carboxamide Openeye Name: N-(3-amino-3-imino-propyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-imidazole-2-carbonyl)amino]imidazole-2-carbonyl]amino]imidazole-2-carboxamide CAS Name: N-(3-amino-3-iminopropyl)-1-methyl-4-[[[1-methyl-4-[[(1-methyl-4-nitro-2-imidazolyl)-oxomethyl]amino]-2-imidazolyl]-oxomethyl]amino]-2-imidazolecarboxamide IUPAC Name: N-(3-amino-3-iminopropyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitroimidazole-2-carbonyl)amino]imidazole-2-carbonyl]amino]imidazole-2-carboxamide Traditional Name: N-(3-amino-3-imino-propyl)-1-methyl-4-[[1-methyl-4-[(1-methyl-4-nitro-imidazole-2-carbonyl)amino]imidazole-2-carbonyl]amino]imidazole-2-carboxamide Formula: C18H22N12O5 MolecularWeight: 486.44468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C(=O)NCCC(=N)N)NC(=O)C2=NC(=CN2C)NC(=O)C3=NC(=CN3C)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(N=C1C(=O)NCCC(=N)N)NC(=O)C2=NC(=CN2C)NC(=O)C3=NC(=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N12O5/c1-27-6-10(22-13(27)16(31)21-5-4-9(19)20)24-17(32)14-23-11(7-28(14)2)25-18(33)15-26-12(30(34)35)8-29(15)3/h6-8H,4-5H2,1-3H3,(H3,19,20)(H,21,31)(H,24,32)(H,25,33)