N-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-benzimidazole-5-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-benzimidazole-5-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-benzimidazole-5-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)methylthio]-3-methyl-5-benzimidazolecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-3-methylbenzimidazole-5-carboxamide Traditional Name: N-(4-chlorobenzyl)-2-[(4-fluorobenzyl)thio]-3-methyl-benzimidazole-5-carboxamide Formula: C23H19ClFN3OS MolecularWeight: 439.932863

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NCC3=CC=C(C=C3)Cl)N=C1SCC4=CC=C(C=C4)F

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NCC3=CC=C(C=C3)Cl)N=C1SCC4=CC=C(C=C4)F

InChI

InChI=1S/C23H19ClFN3OS/c1-28-21-12-17(22(29)26-13-15-2-7-18(24)8-3-15)6-11-20(21)27-23(28)30-14-16-4-9-19(25)10-5-16/h2-12H,13-14H2,1H3,(H,26,29)