N-(1,3-benzodioxol-5-yl)-2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]acetamide Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H18ClN3O3S/c1-2-7-23-15-5-3-12(20)8-14(15)22-19(23)27-10-18(24)21-13-4-6-16-17(9-13)26-11-25-16/h3-6,8-9H,2,7,10-11H2,1H3,(H,21,24)