6-(1,2-dithian-3-yl)-5-(4-ethylsulfonylphenoxy)-2-pyridin-2-yl-1H-benzimidazole

Systemtic Name: 6-(1,2-dithian-3-yl)-5-(4-ethylsulfonylphenoxy)-2-pyridin-2-yl-1H-benzimidazole Openeye Name: 6-(dithian-3-yl)-5-(4-ethylsulfonylphenoxy)-2-(2-pyridyl)-1H-benzimidazole CAS Name: 6-(3-dithianyl)-5-(4-ethylsulfonylphenoxy)-2-(2-pyridinyl)-1H-benzimidazole IUPAC Name: 6-(dithian-3-yl)-5-(4-ethylsulfonylphenoxy)-2-pyridin-2-yl-1H-benzimidazole Traditional Name: 6-(dithian-3-yl)-5-(4-esylphenoxy)-2-(2-pyridyl)-1H-benzimidazole Formula: C24H23N3O3S3 MolecularWeight: 497.65272

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)OC2=CC3=C(C=C2C4CCCSS4)NC(=N3)C5=CC=CC=N5

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)OC2=CC3=C(C=C2C4CCCSS4)NC(=N3)C5=CC=CC=N5

InChI

InChI=1S/C24H23N3O3S3/c1-2-33(28,29)17-10-8-16(9-11-17)30-22-15-21-20(14-18(22)23-7-5-13-31-32-23)26-24(27-21)19-6-3-4-12-25-19/h3-4,6,8-12,14-15,23H,2,5,7,13H2,1H3,(H,26,27)