N-(3-azanyl-3-azanylidene-propyl)-2-methyl-5-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrazole-3-carboxamide

Systemtic Name: N-(3-azanyl-3-azanylidene-propyl)-2-methyl-5-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrazole-3-carboxamide Openeye Name: N-(3-amino-3-imino-propyl)-2-methyl-5-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrazole-3-carboxamide CAS Name: N-(3-amino-3-iminopropyl)-2-methyl-5-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-3-pyrazolecarboxamide IUPAC Name: N-(3-amino-3-iminopropyl)-2-methyl-5-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrazole-3-carboxamide Traditional Name: N-(3-amino-3-imino-propyl)-2-methyl-5-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrazole-3-carboxamide Formula: C14H18N8O4 MolecularWeight: 362.34392

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=NN(C(=C2)C(=O)NCCC(=N)N)C)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=NN(C(=C2)C(=O)NCCC(=N)N)C)[N+](=O)[O-]

InChI

InChI=1S/C14H18N8O4/c1-20-7-8(22(25)26)5-9(20)14(24)18-12-6-10(21(2)19-12)13(23)17-4-3-11(15)16/h5-7H,3-4H2,1-2H3,(H3,15,16)(H,17,23)(H,18,19,24)