N-(1,3-benzodioxol-5-yl)-2-(1-propylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(1-propylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(1-propylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(1-propyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(1-propylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(1-propylimidazol-2-yl)thio]acetamide Formula: C15H17N3O3S MolecularWeight: 319.37878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCN1C=CN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H17N3O3S/c1-2-6-18-7-5-16-15(18)22-9-14(19)17-11-3-4-12-13(8-11)21-10-20-12/h3-5,7-8H,2,6,9-10H2,1H3,(H,17,19)