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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)CCN3C(=CC=N3)C(=O)O

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)CCN3C(=CC=N3)C(=O)O

InChI

InChI=1S/C17H18N6O5/c1-22-10-12(15(21-22)16(25)18-9-11-3-2-8-28-11)20-14(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,20,24)(H,26,27)