3-[[3-(1H-benzimidazol-2-ylsulfanylmethyl)oxetan-3-yl]methyl]-1H-benzimidazole-2-thione

Systemtic Name: 3-[[3-(1H-benzimidazol-2-ylsulfanylmethyl)oxetan-3-yl]methyl]-1H-benzimidazole-2-thione Openeye Name: 3-[[3-(1H-benzimidazol-2-ylsulfanylmethyl)oxetan-3-yl]methyl]-1H-benzimidazole-2-thione CAS Name: 3-[[3-[(1H-benzimidazol-2-ylthio)methyl]-3-oxetanyl]methyl]-1H-benzimidazole-2-thione IUPAC Name: 3-[[3-(1H-benzimidazol-2-ylsulfanylmethyl)oxetan-3-yl]methyl]-1H-benzimidazole-2-thione Traditional Name: 3-[[3-[(1H-benzimidazol-2-ylthio)methyl]oxetan-3-yl]methyl]-1H-benzimidazole-2-thione Formula: C19H18N4OS2 MolecularWeight: 382.50242

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CO1)(CN2C3=CC=CC=C3NC2=S)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1C(CO1)(CN2C3=CC=CC=C3NC2=S)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C19H18N4OS2/c25-18-22-15-7-3-4-8-16(15)23(18)9-19(10-24-11-19)12-26-17-20-13-5-1-2-6-14(13)21-17/h1-8H,9-12H2,(H,20,21)(H,22,25)