methyl 2-[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoylamino]ethanoate

Systemtic Name: methyl 2-[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoylamino]ethanoate Openeye Name: methyl 2-[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoylamino]acetate CAS Name: 2-[[3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-1-oxopropyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]propanoylamino]acetate Traditional Name: 2-[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoylamino]acetic acid methyl ester Formula: C14H20N4O3 MolecularWeight: 292.3336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NCC(=O)OC

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NCC(=O)OC

InChI

InChI=1S/C14H20N4O3/c1-10-12(11(2)18(17-10)8-4-7-15)5-6-13(19)16-9-14(20)21-3/h4-6,8-9H2,1-3H3,(H,16,19)