3-(4-methylphenyl)-5-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-1,2-oxazole

Systemtic Name: 3-(4-methylphenyl)-5-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-1,2-oxazole Openeye Name: 3-(p-tolyl)-5-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]isoxazole CAS Name: 3-(4-methylphenyl)-5-[[[4-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]isoxazole IUPAC Name: 3-(4-methylphenyl)-5-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-1,2-oxazole Traditional Name: 3-(p-tolyl)-5-[[[4-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]isoxazole Formula: C16H12F3N3OS MolecularWeight: 351.34619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NC=CC(=N3)C(F)(F)F

InChI

InChI=1S/C16H12F3N3OS/c1-10-2-4-11(5-3-10)13-8-12(23-22-13)9-24-15-20-7-6-14(21-15)16(17,18)19/h2-8H,9H2,1H3