N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanylacetamide Traditional Name: 2-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]-N-piperonyl-acetamide Formula: C27H25N3O3S MolecularWeight: 471.5707

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCN1C(=C(N=C1SCC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O3S/c1-2-30-26(21-11-7-4-8-12-21)25(20-9-5-3-6-10-20)29-27(30)34-17-24(31)28-16-19-13-14-22-23(15-19)33-18-32-22/h3-15H,2,16-18H2,1H3,(H,28,31)