2-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(4-ethoxyphenyl)benzimidazole

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(4-ethoxyphenyl)benzimidazole Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(4-ethoxyphenyl)benzimidazole CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-1-(4-ethoxyphenyl)benzimidazole IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-1-(4-ethoxyphenyl)benzimidazole Traditional Name: 2-(piperonylthio)-1-p-phenetyl-benzimidazole Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H20N2O3S/c1-2-26-18-10-8-17(9-11-18)25-20-6-4-3-5-19(20)24-23(25)29-14-16-7-12-21-22(13-16)28-15-27-21/h3-13H,2,14-15H2,1H3