5-chloranyl-3-[[2-nitro-4-(trifluoromethyl)phenyl]sulfanylmethyl]-1-benzothiophene

Systemtic Name: 5-chloranyl-3-[[2-nitro-4-(trifluoromethyl)phenyl]sulfanylmethyl]-1-benzothiophene Openeye Name: 5-chloro-3-[[2-nitro-4-(trifluoromethyl)phenyl]sulfanylmethyl]benzothiophene CAS Name: 5-chloro-3-[[[2-nitro-4-(trifluoromethyl)phenyl]thio]methyl]-1-benzothiophene IUPAC Name: 5-chloro-3-[[2-nitro-4-(trifluoromethyl)phenyl]sulfanylmethyl]-1-benzothiophene Traditional Name: 5-chloro-3-[[[2-nitro-4-(trifluoromethyl)phenyl]thio]methyl]benzothiophene Formula: C16H9ClF3NO2S2 MolecularWeight: 403.82637

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])SCC2=CSC3=C2C=C(C=C3)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])SCC2=CSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C16H9ClF3NO2S2/c17-11-2-4-14-12(6-11)9(7-24-14)8-25-15-3-1-10(16(18,19)20)5-13(15)21(22)23/h1-7H,8H2