5-azanyl-N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-2-methyl-1,2,4-triazole-3-carboxamide

Systemtic Name: 5-azanyl-N-[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-2-methyl-1,2,4-triazole-3-carboxamide Openeye Name: 5-amino-N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-2-methyl-1,2,4-triazole-3-carboxamide CAS Name: 5-amino-N-[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-methyl-3-pyrrolyl]-2-methyl-1,2,4-triazole-3-carboxamide IUPAC Name: 5-amino-N-[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]-2-methyl-1,2,4-triazole-3-carboxamide Traditional Name: 5-amino-N-[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]-2-methyl-1,2,4-triazole-3-carboxamide Formula: C13H19N9O2 MolecularWeight: 333.34906

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=O)C2=NC(=NN2C)N

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCC(=N)N)NC(=O)C2=NC(=NN2C)N

InChI

InChI=1S/C13H19N9O2/c1-21-6-7(5-8(21)11(23)17-4-3-9(14)15)18-12(24)10-19-13(16)20-22(10)2/h5-6H,3-4H2,1-2H3,(H3,14,15)(H2,16,20)(H,17,23)(H,18,24)