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

Systemtic Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetamide Formula: C20H20N4O5S MolecularWeight: 428.4616

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=CC=CC=C2N=C1SCC(=O)NC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COCCN1C2=CC=CC=C2N=C1SCC(=O)NC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N4O5S/c1-27-9-8-24-15-5-3-2-4-14(15)22-20(24)30-11-18(25)23-19(26)21-13-6-7-16-17(10-13)29-12-28-16/h2-7,10H,8-9,11-12H2,1H3,(H2,21,23,25,26)