3-[5-[[1-ethyl-5-(furan-2-ylmethylcarbamoyl)pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[5-[[1-ethyl-5-(furan-2-ylmethylcarbamoyl)pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[5-[[1-ethyl-5-(2-furylmethylcarbamoyl)pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[5-[[[1-ethyl-5-[(2-furanylmethylamino)-oxomethyl]-4-pyrazolyl]amino]-oxomethyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[5-[[1-ethyl-5-(furan-2-ylmethylcarbamoyl)pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[5-[[1-ethyl-5-(2-furfurylcarbamoyl)pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propionic acid Formula: C18H20N6O5 MolecularWeight: 400.3886

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=O)C2=CC=NN2CCC(=O)O)C(=O)NCC3=CC=CO3

Isomeric SMILES

CCN1C(=C(C=N1)NC(=O)C2=CC=NN2CCC(=O)O)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C18H20N6O5/c1-2-23-16(18(28)19-10-12-4-3-9-29-12)13(11-21-23)22-17(27)14-5-7-20-24(14)8-6-15(25)26/h3-5,7,9,11H,2,6,8,10H2,1H3,(H,19,28)(H,22,27)(H,25,26)