N-(1,3-benzodioxol-5-yl)-2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]propionamide Formula: C17H13ClF3NO3S MolecularWeight: 403.80323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClF3NO3S/c1-9(26-11-3-4-13(18)12(7-11)17(19,20)21)16(23)22-10-2-5-14-15(6-10)25-8-24-14/h2-7,9H,8H2,1H3,(H,22,23)