ethyl 2-chloranyl-5-[2-methylsulfonyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]benzoate

Systemtic Name: ethyl 2-chloranyl-5-[2-methylsulfonyl-6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]benzoate Openeye Name: ethyl 2-chloro-5-[2-methylsulfonyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate CAS Name: 2-chloro-5-[2-methylsulfonyl-6-oxo-4-(trifluoromethyl)-1-pyrimidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-[2-methylsulfonyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]benzoate Traditional Name: 2-chloro-5-[6-keto-2-mesyl-4-(trifluoromethyl)pyrimidin-1-yl]benzoic acid ethyl ester Formula: C15H12ClF3N2O5S MolecularWeight: 424.77939

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C=C(N=C2S(=O)(=O)C)C(F)(F)F)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C=C(N=C2S(=O)(=O)C)C(F)(F)F)Cl

InChI

InChI=1S/C15H12ClF3N2O5S/c1-3-26-13(23)9-6-8(4-5-10(9)16)21-12(22)7-11(15(17,18)19)20-14(21)27(2,24)25/h4-7H,3H2,1-2H3