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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-N-piperonyl-acetamide Formula: C17H13ClF3NO3S MolecularWeight: 403.80323

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CSC3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C17H13ClF3NO3S/c18-13-3-2-11(6-12(13)17(19,20)21)26-8-16(23)22-7-10-1-4-14-15(5-10)25-9-24-14/h1-6H,7-9H2,(H,22,23)