2-[3-[[3-[(1-methylpyrazol-3-yl)carbonylamino]phenyl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[[3-[(1-methylpyrazol-3-yl)carbonylamino]phenyl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[3-[(1-methylpyrazole-3-carbonyl)amino]anilino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[3-[[(1-methyl-3-pyrazolyl)-oxomethyl]amino]anilino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[3-[(1-methylpyrazole-3-carbonyl)amino]anilino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-keto-3-[3-[(1-methylpyrazole-3-carbonyl)amino]anilino]propyl]pyrazole-3-carboxylic acid Formula: C18H18N6O4 MolecularWeight: 382.37332

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)NC2=CC(=CC=C2)NC(=O)CCN3C(=CC=N3)C(=O)O

Isomeric SMILES

CN1C=CC(=N1)C(=O)NC2=CC(=CC=C2)NC(=O)CCN3C(=CC=N3)C(=O)O

InChI

InChI=1S/C18H18N6O4/c1-23-9-6-14(22-23)17(26)21-13-4-2-3-12(11-13)20-16(25)7-10-24-15(18(27)28)5-8-19-24/h2-6,8-9,11H,7,10H2,1H3,(H,20,25)(H,21,26)(H,27,28)