5-[[5-(furan-2-ylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[[5-(furan-2-ylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[[5-(2-furylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[[5-[(2-furanylmethylamino)-oxomethyl]-1-methyl-4-pyrazolyl]amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[[5-(furan-2-ylmethylcarbamoyl)-1-methylpyrazol-4-yl]carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[[5-(2-furfurylcarbamoyl)-1-methyl-pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C16H16N6O5 MolecularWeight: 372.33544

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=C(N(N=C2)C)C(=O)NCC3=CC=CO3

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=C(N(N=C2)C)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C16H16N6O5/c1-21-12(10(7-18-21)16(25)26)15(24)20-11-8-19-22(2)13(11)14(23)17-6-9-4-3-5-27-9/h3-5,7-8H,6H2,1-2H3,(H,17,23)(H,20,24)(H,25,26)