2-(1H-benzimidazol-2-ylsulfanyl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(1H-benzimidazol-2-ylsulfanyl)acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(1H-benzimidazol-2-ylthio)acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(1H-benzimidazol-2-ylsulfanyl)acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(1H-benzimidazol-2-ylthio)acetamide Formula: C18H15N3O4S MolecularWeight: 369.3944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=NC4=CC=CC=C4N3)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=NC4=CC=CC=C4N3)OCO2

InChI

InChI=1S/C18H15N3O4S/c1-10(22)11-6-15-16(25-9-24-15)7-14(11)19-17(23)8-26-18-20-12-4-2-3-5-13(12)21-18/h2-7H,8-9H2,1H3,(H,19,23)(H,20,21)