2-[3-cyano-6-(phenylmethyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanamide

Systemtic Name: 2-[3-cyano-6-(phenylmethyl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylethanamide Openeye Name: 2-[[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: 2-[[3-cyano-6-(phenylmethyl)-4-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: 2-[6-benzyl-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: 2-[[6-benzyl-3-cyano-4-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C16H12F3N3OS MolecularWeight: 351.34619

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)N

InChI

InChI=1S/C16H12F3N3OS/c17-16(18,19)13-7-11(6-10-4-2-1-3-5-10)22-15(12(13)8-20)24-9-14(21)23/h1-5,7H,6,9H2,(H2,21,23)