2-[3-[(5-aminocarbonyl-1-methyl-pyrazol-4-yl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[(5-aminocarbonyl-1-methyl-pyrazol-4-yl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[(5-carbamoyl-1-methyl-pyrazol-4-yl)amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[(5-carbamoyl-1-methyl-4-pyrazolyl)amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[(5-carbamoyl-1-methylpyrazol-4-yl)amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[(5-carbamoyl-1-methyl-pyrazol-4-yl)amino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C12H14N6O4 MolecularWeight: 306.27736

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NC(=O)CCN2C(=CC=N2)C(=O)O)C(=O)N

Isomeric SMILES

CN1C(=C(C=N1)NC(=O)CCN2C(=CC=N2)C(=O)O)C(=O)N

InChI

InChI=1S/C12H14N6O4/c1-17-10(11(13)20)7(6-15-17)16-9(19)3-5-18-8(12(21)22)2-4-14-18/h2,4,6H,3,5H2,1H3,(H2,13,20)(H,16,19)(H,21,22)