(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(furan-2-ylcarbonylamino)propanoate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(furan-2-ylcarbonylamino)propanoate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(furan-2-carbonylamino)propanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]propanoic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl 2-(furan-2-carbonylamino)propanoate Traditional Name: 2-(2-furoylamino)propionic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C20H18N4O4 MolecularWeight: 378.38132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)COC(=O)C(C)NC(=O)C2=CC=CO2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)COC(=O)C(C)NC(=O)C2=CC=CO2)C3=CC=CC=C3

InChI

InChI=1S/C20H18N4O4/c1-13-16(11-21)17(24(23-13)15-7-4-3-5-8-15)12-28-20(26)14(2)22-19(25)18-9-6-10-27-18/h3-10,14H,12H2,1-2H3,(H,22,25)