1-(methylsulfanylmethyl)-3-[[1-(4-oxidanylbutyl)benzimidazol-2-yl]methyl]benzimidazol-2-one

Systemtic Name: 1-(methylsulfanylmethyl)-3-[[1-(4-oxidanylbutyl)benzimidazol-2-yl]methyl]benzimidazol-2-one Openeye Name: 1-[[1-(4-hydroxybutyl)benzimidazol-2-yl]methyl]-3-(methylsulfanylmethyl)benzimidazol-2-one CAS Name: 1-[[1-(4-hydroxybutyl)-2-benzimidazolyl]methyl]-3-[(methylthio)methyl]-2-benzimidazolone IUPAC Name: 1-[[1-(4-hydroxybutyl)benzimidazol-2-yl]methyl]-3-(methylsulfanylmethyl)benzimidazol-2-one Traditional Name: 1-[[1-(4-hydroxybutyl)benzimidazol-2-yl]methyl]-3-[(methylthio)methyl]benzimidazol-2-one Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CSCN1C2=CC=CC=C2N(C1=O)CC3=NC4=CC=CC=C4N3CCCCO

Isomeric SMILES

CSCN1C2=CC=CC=C2N(C1=O)CC3=NC4=CC=CC=C4N3CCCCO

InChI

InChI=1S/C21H24N4O2S/c1-28-15-25-19-11-5-4-10-18(19)24(21(25)27)14-20-22-16-8-2-3-9-17(16)23(20)12-6-7-13-26/h2-5,8-11,26H,6-7,12-15H2,1H3