2-[3-[(3-aminocarbonyl-1-ethyl-pyrazol-4-yl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[(3-aminocarbonyl-1-ethyl-pyrazol-4-yl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[(3-carbamoyl-1-ethyl-pyrazol-4-yl)amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[(3-carbamoyl-1-ethyl-4-pyrazolyl)amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[(3-carbamoyl-1-ethylpyrazol-4-yl)amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[(3-carbamoyl-1-ethyl-pyrazol-4-yl)amino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C13H16N6O4 MolecularWeight: 320.30394

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N)NC(=O)CCN2C(=CC=N2)C(=O)O

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N)NC(=O)CCN2C(=CC=N2)C(=O)O

InChI

InChI=1S/C13H16N6O4/c1-2-18-7-8(11(17-18)12(14)21)16-10(20)4-6-19-9(13(22)23)3-5-15-19/h3,5,7H,2,4,6H2,1H3,(H2,14,21)(H,16,20)(H,22,23)