[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate

Systemtic Name: [2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate Openeye Name: [2-(2,4-dimethoxyphenyl)-2-oxo-ethyl] 3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate CAS Name: 3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoic acid [2-(2,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyphenyl)-2-oxoethyl] 3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoate Traditional Name: 3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propionic acid [2-(2,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=NC=NN12)C)CCC(=O)OCC(=O)C3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C(=NC2=NC=NN12)C)CCC(=O)OCC(=O)C3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C20H22N4O5/c1-12-15(13(2)24-20(23-12)21-11-22-24)7-8-19(26)29-10-17(25)16-6-5-14(27-3)9-18(16)28-4/h5-6,9,11H,7-8,10H2,1-4H3