N-(2-bromophenyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-bromophenyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(2-bromophenyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(2-bromophenyl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(2-bromophenyl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C16H11BrF3N3OS MolecularWeight: 430.24225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C16H11BrF3N3OS/c1-9-6-11(16(18,19)20)10(7-21)15(22-9)25-8-14(24)23-13-5-3-2-4-12(13)17/h2-6H,8H2,1H3,(H,23,24)