2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-6-(trifluoromethyl)-1H-benzimidazole IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-(trifluoromethyl)-1H-benzimidazole Traditional Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-6-(trifluoromethyl)-1H-benzimidazole Formula: C17H12ClF3N2O2S MolecularWeight: 400.80259

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=C(N3)C=C(C=C4)C(F)(F)F)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NC4=C(N3)C=C(C=C4)C(F)(F)F)Cl

InChI

InChI=1S/C17H12ClF3N2O2S/c18-12-3-9-6-24-8-25-15(9)10(4-12)7-26-16-22-13-2-1-11(17(19,20)21)5-14(13)23-16/h1-5H,6-8H2,(H,22,23)