N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C16H12BrF3N2O3S MolecularWeight: 449.24229

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)NC(=O)CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)NC(=O)CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H12BrF3N2O3S/c17-10-5-12-13(25-4-3-24-12)6-11(10)22-14(23)8-26-15-2-1-9(7-21-15)16(18,19)20/h1-2,5-7H,3-4,8H2,(H,22,23)