2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1-(4-methoxyphenyl)benzimidazole

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-1-(4-methoxyphenyl)benzimidazole Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1-(4-methoxyphenyl)benzimidazole CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-1-(4-methoxyphenyl)benzimidazole IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-1-(4-methoxyphenyl)benzimidazole Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-1-(4-methoxyphenyl)benzimidazole Formula: C21H16ClFN2OS MolecularWeight: 398.880943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=C(C=CC=C4Cl)F

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H16ClFN2OS/c1-26-15-11-9-14(10-12-15)25-20-8-3-2-7-19(20)24-21(25)27-13-16-17(22)5-4-6-18(16)23/h2-12H,13H2,1H3