2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-methyl-1H-benzimidazole

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-methyl-1H-benzimidazole Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-methyl-1H-benzimidazole CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-6-methyl-1H-benzimidazole IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-6-methyl-1H-benzimidazole Traditional Name: 6-methyl-2-(piperonylthio)-1H-benzimidazole Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H14N2O2S/c1-10-2-4-12-13(6-10)18-16(17-12)21-8-11-3-5-14-15(7-11)20-9-19-14/h2-7H,8-9H2,1H3,(H,17,18)