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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]acetamide Formula: C16H11ClF3NO3S MolecularWeight: 389.77665

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClF3NO3S/c17-12-3-2-10(6-11(12)16(18,19)20)25-7-15(22)21-9-1-4-13-14(5-9)24-8-23-13/h1-6H,7-8H2,(H,21,22)