N-(1,3-benzodioxol-5-yl)-2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(1-benzylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[1-(phenylmethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(1-benzylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(1-benzylbenzimidazol-2-yl)thio]acetamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N3CC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N3CC5=CC=CC=C5

InChI

InChI=1S/C23H19N3O3S/c27-22(24-17-10-11-20-21(12-17)29-15-28-20)14-30-23-25-18-8-4-5-9-19(18)26(23)13-16-6-2-1-3-7-16/h1-12H,13-15H2,(H,24,27)