N-(3-cyano-4-methyl-phenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-4-methyl-phenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-cyano-4-methyl-phenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(3-cyano-4-methylphenyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(3-cyano-4-methylphenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(3-cyano-4-methyl-phenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C16H12F3N3OS MolecularWeight: 351.34619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC=C(C=C2)C(F)(F)F)C#N

InChI

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