thiolan-3-yl 2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]benzoate

Systemtic Name: thiolan-3-yl 2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]benzoate Openeye Name: tetrahydrothiophen-3-yl 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate CAS Name: 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]benzoic acid 3-thiolanyl ester IUPAC Name: thiolan-3-yl 2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate Traditional Name: 2-chloro-5-[2,6-diketo-3-methyl-4-(trifluoromethyl)pyrimidin-1-yl]-4-fluoro-benzoic acid tetrahydrothiophen-3-yl ester Formula: C17H13ClF4N2O4S MolecularWeight: 452.807733

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C(=O)OC3CCSC3)Cl)F)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=C(C=C(C(=C2)C(=O)OC3CCSC3)Cl)F)C(F)(F)F

InChI

InChI=1S/C17H13ClF4N2O4S/c1-23-13(17(20,21)22)6-14(25)24(16(23)27)12-4-9(10(18)5-11(12)19)15(26)28-8-2-3-29-7-8/h4-6,8H,2-3,7H2,1H3