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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=O)C2=CC(=NN2C)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=O)C2=CC(=NN2C)[N+](=O)[O-]

InChI

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