N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(methylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(methylthio)-4-(trifluoromethyl)pyrimidine-5-carboxamide Formula: C15H12F3N3O3S MolecularWeight: 371.33429

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(F)(F)F)C(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CSC1=NC=C(C(=N1)C(F)(F)F)C(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H12F3N3O3S/c1-25-14-19-7-9(12(21-14)15(16,17)18)13(22)20-8-2-3-10-11(6-8)24-5-4-23-10/h2-3,6-7H,4-5H2,1H3,(H,20,22)