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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[(3-methoxyphenyl)methyl]-3-methyl-benzimidazole-5-carboxamide Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[(3-methoxyphenyl)methyl]-3-methyl-benzimidazole-5-carboxamide CAS Name: 2-[(4-fluorophenyl)methylthio]-N-[(3-methoxyphenyl)methyl]-3-methyl-5-benzimidazolecarboxamide IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[(3-methoxyphenyl)methyl]-3-methylbenzimidazole-5-carboxamide Traditional Name: 2-[(4-fluorobenzyl)thio]-N-m-anisyl-3-methyl-benzimidazole-5-carboxamide Formula: C24H22FN3O2S MolecularWeight: 435.513783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22FN3O2S/c1-28-22-13-18(23(29)26-14-17-4-3-5-20(12-17)30-2)8-11-21(22)27-24(28)31-15-16-6-9-19(25)10-7-16/h3-13H,14-15H2,1-2H3,(H,26,29)