N-(1,3-benzodioxol-5-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]propionamide Formula: C16H13F3N2O3S MolecularWeight: 370.34623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H13F3N2O3S/c1-9(25-14-5-2-10(7-20-14)16(17,18)19)15(22)21-11-3-4-12-13(6-11)24-8-23-12/h2-7,9H,8H2,1H3,(H,21,22)