N-(5-bromanyl-1,3-benzothiazol-2-yl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-bromanyl-1,3-benzothiazol-2-yl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(5-bromo-1,3-benzothiazol-2-yl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(5-bromo-1,3-benzothiazol-2-yl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(5-bromo-1,3-benzothiazol-2-yl)-2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(5-bromo-1,3-benzothiazol-2-yl)-2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C17H10BrF3N4OS2 MolecularWeight: 487.31671

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC(=O)NC2=NC3=C(S2)C=CC(=C3)Br

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCC(=O)NC2=NC3=C(S2)C=CC(=C3)Br

InChI

InChI=1S/C17H10BrF3N4OS2/c1-8-4-11(17(19,20)21)10(6-22)15(23-8)27-7-14(26)25-16-24-12-5-9(18)2-3-13(12)28-16/h2-5H,7H2,1H3,(H,24,25,26)