N-(2-bromanyl-4-methyl-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]propionamide Formula: C15H13BrF3N3OS MolecularWeight: 420.24743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC=CC(=N2)C(F)(F)F)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NC=CC(=N2)C(F)(F)F)Br

InChI

InChI=1S/C15H13BrF3N3OS/c1-8-3-4-11(10(16)7-8)21-13(23)9(2)24-14-20-6-5-12(22-14)15(17,18)19/h3-7,9H,1-2H3,(H,21,23)