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

Systemtic Name: N-[(4-ethylphenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-benzimidazole-5-carboxamide Openeye Name: N-[(4-ethylphenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-benzimidazole-5-carboxamide CAS Name: N-[(4-ethylphenyl)methyl]-2-[(4-fluorophenyl)methylthio]-3-methyl-5-benzimidazolecarboxamide IUPAC Name: N-[(4-ethylphenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-3-methylbenzimidazole-5-carboxamide Traditional Name: N-(4-ethylbenzyl)-2-[(4-fluorobenzyl)thio]-3-methyl-benzimidazole-5-carboxamide Formula: C25H24FN3OS MolecularWeight: 433.540963

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N=C(N3C)SCC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)N=C(N3C)SCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H24FN3OS/c1-3-17-4-6-18(7-5-17)15-27-24(30)20-10-13-22-23(14-20)29(2)25(28-22)31-16-19-8-11-21(26)12-9-19/h4-14H,3,15-16H2,1-2H3,(H,27,30)