3-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide

Systemtic Name: 3-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Openeye Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide CAS Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide IUPAC Name: 3-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Traditional Name: 3-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridyl]thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propionamide Formula: C19H16F3N3O3S MolecularWeight: 423.40885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H16F3N3O3S/c1-11-8-14(19(20,21)22)13(10-23)18(24-11)29-7-4-17(26)25-12-2-3-15-16(9-12)28-6-5-27-15/h2-3,8-9H,4-7H2,1H3,(H,25,26)