N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-thiophen-2-ylsulfonylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-thiophen-2-ylsulfonylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[1-(2-thienylsulfonyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-thiophen-2-ylsulfonyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-thiophen-2-ylsulfonylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[1-(2-thienylsulfonyl)benzimidazol-2-yl]thio]acetamide Formula: C21H17N3O5S3 MolecularWeight: 487.57178

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4N3S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4N3S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C21H17N3O5S3/c25-19(22-14-7-8-17-18(12-14)29-10-9-28-17)13-31-21-23-15-4-1-2-5-16(15)24(21)32(26,27)20-6-3-11-30-20/h1-8,11-12H,9-10,13H2,(H,22,25)