ethyl 1-[3-[3-(furan-2-ylcarbonylamino)propanoylamino]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-[3-(furan-2-ylcarbonylamino)propanoylamino]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-[3-(furan-2-carbonylamino)propanoylamino]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[3-[[3-[[2-furanyl(oxo)methyl]amino]-1-oxopropyl]amino]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[3-(furan-2-carbonylamino)propanoylamino]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[3-[3-(2-furoylamino)propanoylamino]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CCNC(=O)C3=CC=CO3)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CCNC(=O)C3=CC=CO3)C

InChI

InChI=1S/C21H22N4O5/c1-3-29-21(28)17-13-23-25(14(17)2)16-7-4-6-15(12-16)24-19(26)9-10-22-20(27)18-8-5-11-30-18/h4-8,11-13H,3,9-10H2,1-2H3,(H,22,27)(H,24,26)