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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylbutanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]butyramide Formula: C19H15F3N4OS2 MolecularWeight: 436.47381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H15F3N4OS2/c1-11-9-13(19(20,21)22)12(10-23)17(24-11)28-8-4-7-16(27)26-18-25-14-5-2-3-6-15(14)29-18/h2-3,5-6,9H,4,7-8H2,1H3,(H,25,26,27)