N-(1,3-benzodioxol-5-yl)-2-[(6-ethanoyl-2,3-dimethoxy-phenoxy)methyl]morpholine-4-carbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(6-ethanoyl-2,3-dimethoxy-phenoxy)methyl]morpholine-4-carbothioamide Openeye Name: 2-[(6-acetyl-2,3-dimethoxy-phenoxy)methyl]-N-(1,3-benzodioxol-5-yl)morpholine-4-carbothioamide CAS Name: 2-[(6-acetyl-2,3-dimethoxyphenoxy)methyl]-N-(1,3-benzodioxol-5-yl)-4-morpholinecarbothioamide IUPAC Name: 2-[(6-acetyl-2,3-dimethoxyphenoxy)methyl]-N-(1,3-benzodioxol-5-yl)morpholine-4-carbothioamide Traditional Name: 2-[(6-acetyl-2,3-dimethoxy-phenoxy)methyl]-N-(1,3-benzodioxol-5-yl)morpholine-4-carbothioamide Formula: C23H26N2O7S MolecularWeight: 474.52674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(C=C1)OC)OC)OCC2CN(CCO2)C(=S)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=C(C(=C(C=C1)OC)OC)OCC2CN(CCO2)C(=S)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H26N2O7S/c1-14(26)17-5-7-19(27-2)22(28-3)21(17)30-12-16-11-25(8-9-29-16)23(33)24-15-4-6-18-20(10-15)32-13-31-18/h4-7,10,16H,8-9,11-13H2,1-3H3,(H,24,33)