N-(1,3-benzodioxol-5-ylmethyl)-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-isopropylsulfanylbenzimidazol-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(propan-2-ylthio)-1-benzimidazolyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-propan-2-ylsulfanylbenzimidazol-1-yl)acetamide Traditional Name: 2-[2-(isopropylthio)benzimidazol-1-yl]-N-piperonyl-acetamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC2=CC=CC=C2N1CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)SC1=NC2=CC=CC=C2N1CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O3S/c1-13(2)27-20-22-15-5-3-4-6-16(15)23(20)11-19(24)21-10-14-7-8-17-18(9-14)26-12-25-17/h3-9,13H,10-12H2,1-2H3,(H,21,24)