tert-butyl 3-[[2,6-bis(oxidanylidene)-3-(oxolan-2-yl)-5-(trifluoromethyl)pyrimidin-1-yl]methyl]thiophene-2-carboxylate

Systemtic Name: tert-butyl 3-[[2,6-bis(oxidanylidene)-3-(oxolan-2-yl)-5-(trifluoromethyl)pyrimidin-1-yl]methyl]thiophene-2-carboxylate Openeye Name: tert-butyl 3-[[2,6-dioxo-3-tetrahydrofuran-2-yl-5-(trifluoromethyl)pyrimidin-1-yl]methyl]thiophene-2-carboxylate CAS Name: 3-[[2,6-dioxo-3-(2-oxolanyl)-5-(trifluoromethyl)-1-pyrimidinyl]methyl]-2-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2,6-dioxo-3-(oxolan-2-yl)-5-(trifluoromethyl)pyrimidin-1-yl]methyl]thiophene-2-carboxylate Traditional Name: 3-[[2,6-diketo-3-(tetrahydrofuryl)-5-(trifluoromethyl)pyrimidin-1-yl]methyl]thiophene-2-carboxylic acid tert-butyl ester Formula: C19H21F3N2O5S MolecularWeight: 446.44065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CS1)CN2C(=O)C(=CN(C2=O)C3CCCO3)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CS1)CN2C(=O)C(=CN(C2=O)C3CCCO3)C(F)(F)F

InChI

InChI=1S/C19H21F3N2O5S/c1-18(2,3)29-16(26)14-11(6-8-30-14)9-24-15(25)12(19(20,21)22)10-23(17(24)27)13-5-4-7-28-13/h6,8,10,13H,4-5,7,9H2,1-3H3