2-[(4R)-3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[(4R)-3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]-N-phenyl-ethanamide Openeye Name: 2-[(4R)-3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-5-oxo-2-thioxo-imidazolidin-4-yl]-N-phenyl-acetamide CAS Name: 2-[(4R)-3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-5-oxo-2-sulfanylidene-4-imidazolidinyl]-N-phenylacetamide IUPAC Name: 2-[(4R)-3-(1,3-benzodioxol-5-ylmethyl)-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-phenylacetamide Traditional Name: 2-[(4R)-1-ethyl-5-keto-3-piperonyl-2-thioxo-imidazolidin-4-yl]-N-phenyl-acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(N(C1=S)CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)[C@H](N(C1=S)CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O4S/c1-2-23-20(26)16(11-19(25)22-15-6-4-3-5-7-15)24(21(23)29)12-14-8-9-17-18(10-14)28-13-27-17/h3-10,16H,2,11-13H2,1H3,(H,22,25)/t16-/m1/s1