1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]ethanone Openeye Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[2-(phenylmethylthio)-1-benzimidazolyl]ethanone IUPAC Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Traditional Name: 2-[2-(benzylthio)benzimidazol-1-yl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5

InChI

InChI=1S/C24H20N2O3S/c27-21(18-10-11-22-23(14-18)29-13-12-28-22)15-26-20-9-5-4-8-19(20)25-24(26)30-16-17-6-2-1-3-7-17/h1-11,14H,12-13,15-16H2