bis(prop-2-enyl) 2-[[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonylamino]pentanedioate

Systemtic Name: bis(prop-2-enyl) 2-[[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonylamino]pentanedioate Openeye Name: diallyl 2-[[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]pentanedioate CAS Name: 2-[[[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinyl]-oxomethyl]amino]pentanedioic acid bis(prop-2-enyl) ester IUPAC Name: bis(prop-2-enyl) 2-[[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]pentanedioate Traditional Name: 2-[[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]amino]glutaric acid diallyl ester Formula: C27H27F3N4O7 MolecularWeight: 576.52109

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)(F)F)C(=O)NC(CCC(=O)OCC=C)C(=O)OCC=C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)(F)F)C(=O)NC(CCC(=O)OCC=C)C(=O)OCC=C)OC

InChI

InChI=1S/C27H27F3N4O7/c1-5-11-40-23(35)10-8-18(26(37)41-12-6-2)33-25(36)17-15-31-34-22(27(28,29)30)14-19(32-24(17)34)16-7-9-20(38-3)21(13-16)39-4/h5-7,9,13-15,18H,1-2,8,10-12H2,3-4H3,(H,33,36)