2-ethylsulfanyl-N-[(4-fluorophenyl)methyl]-1-(phenylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: 2-ethylsulfanyl-N-[(4-fluorophenyl)methyl]-1-(phenylmethyl)benzimidazole-5-sulfonamide Openeye Name: 1-benzyl-2-ethylsulfanyl-N-[(4-fluorophenyl)methyl]benzimidazole-5-sulfonamide CAS Name: 2-(ethylthio)-N-[(4-fluorophenyl)methyl]-1-(phenylmethyl)-5-benzimidazolesulfonamide IUPAC Name: 1-benzyl-2-ethylsulfanyl-N-[(4-fluorophenyl)methyl]benzimidazole-5-sulfonamide Traditional Name: 1-benzyl-2-(ethylthio)-N-(4-fluorobenzyl)benzimidazole-5-sulfonamide Formula: C23H22FN3O2S2 MolecularWeight: 455.568083

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)S(=O)(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CCSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)S(=O)(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FN3O2S2/c1-2-30-23-26-21-14-20(31(28,29)25-15-17-8-10-19(24)11-9-17)12-13-22(21)27(23)16-18-6-4-3-5-7-18/h3-14,25H,2,15-16H2,1H3