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

Systemtic Name: 2-[3-[[5-(furan-2-ylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[[5-(2-furylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[[5-[(2-furanylmethylamino)-oxomethyl]-1-methyl-4-pyrazolyl]amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[[5-(furan-2-ylmethylcarbamoyl)-1-methylpyrazol-4-yl]amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-[[5-(2-furfurylcarbamoyl)-1-methyl-pyrazol-4-yl]amino]-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C17H18N6O5 MolecularWeight: 386.36202

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NC(=O)CCN2C(=CC=N2)C(=O)O)C(=O)NCC3=CC=CO3

Isomeric SMILES

CN1C(=C(C=N1)NC(=O)CCN2C(=CC=N2)C(=O)O)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C17H18N6O5/c1-22-15(16(25)18-9-11-3-2-8-28-11)12(10-20-22)21-14(24)5-7-23-13(17(26)27)4-6-19-23/h2-4,6,8,10H,5,7,9H2,1H3,(H,18,25)(H,21,24)(H,26,27)