3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(5-methyl-2-oxidanyl-phenyl)propanamide

Systemtic Name: 3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(5-methyl-2-oxidanyl-phenyl)propanamide Openeye Name: N-(2-hydroxy-5-methyl-phenyl)-3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-(2-hydroxy-5-methylphenyl)-3-[[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide IUPAC Name: N-(2-hydroxy-5-methylphenyl)-3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-(2-hydroxy-5-methyl-phenyl)-3-[[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]propionamide Formula: C22H20F3N3O3S MolecularWeight: 463.47271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)NC(=O)CCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)O)NC(=O)CCSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H20F3N3O3S/c1-13-3-8-18(29)17(11-13)26-20(30)9-10-32-21-27-16(12-19(28-21)22(23,24)25)14-4-6-15(31-2)7-5-14/h3-8,11-12,29H,9-10H2,1-2H3,(H,26,30)