5-[[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 5-[[5-[(3-azanyl-3-azanylidene-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrazole-3-carboxylic acid Openeye Name: 5-[[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrazole-3-carboxylic acid CAS Name: 5-[[[5-[[(3-amino-3-iminopropyl)amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]-1-methyl-3-pyrazolecarboxylic acid IUPAC Name: 5-[[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrazole-3-carboxylic acid Traditional Name: 5-[[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrazole-3-carboxylic acid Formula: C15H19N7O4 MolecularWeight: 361.35586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N7O4/c1-21-7-8(5-10(21)13(23)18-4-3-12(16)17)19-14(24)11-6-9(15(25)26)20-22(11)2/h5-7H,3-4H2,1-2H3,(H3,16,17)(H,18,23)(H,19,24)(H,25,26)