6-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-ethoxyphenyl)hexanamide

Systemtic Name: 6-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-ethoxyphenyl)hexanamide Openeye Name: 6-[(5Z)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]-N-(2-ethoxyphenyl)hexanamide CAS Name: 6-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-N-(2-ethoxyphenyl)hexanamide IUPAC Name: 6-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(2-ethoxyphenyl)hexanamide Traditional Name: 6-[(5Z)-4-keto-5-piperonylidene-2-thioxo-thiazolidin-3-yl]-N-o-phenetyl-hexanamide Formula: C25H26N2O5S2 MolecularWeight: 498.61434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CCCCCN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)SC2=S

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CCCCCN2C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/SC2=S

InChI

InChI=1S/C25H26N2O5S2/c1-2-30-19-9-6-5-8-18(19)26-23(28)10-4-3-7-13-27-24(29)22(34-25(27)33)15-17-11-12-20-21(14-17)32-16-31-20/h5-6,8-9,11-12,14-15H,2-4,7,10,13,16H2,1H3,(H,26,28)/b22-15-