2-[3-(1,3-benzodioxol-5-ylmethyl)-5-oxidanylidene-1-(phenylmethyl)-2-sulfanylidene-imidazolidin-4-yl]-N-(4-ethoxyphenyl)ethanamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-oxidanylidene-1-(phenylmethyl)-2-sulfanylidene-imidazolidin-4-yl]-N-(4-ethoxyphenyl)ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-5-oxo-2-thioxo-imidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide CAS Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-oxo-1-(phenylmethyl)-2-sulfanylidene-4-imidazolidinyl]-N-(4-ethoxyphenyl)acetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide Traditional Name: 2-(1-benzyl-5-keto-3-piperonyl-2-thioxo-imidazolidin-4-yl)-N-p-phenetyl-acetamide Formula: C28H27N3O5S MolecularWeight: 517.59608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

InChI

InChI=1S/C28H27N3O5S/c1-2-34-22-11-9-21(10-12-22)29-26(32)15-23-27(33)31(16-19-6-4-3-5-7-19)28(37)30(23)17-20-8-13-24-25(14-20)36-18-35-24/h3-14,23H,2,15-18H2,1H3,(H,29,32)