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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-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-ylmethyl)morpholine-4-carbothioamide CAS Name: 2-[(6-acetyl-2,3-dimethoxyphenoxy)methyl]-N-(1,3-benzodioxol-5-ylmethyl)-4-morpholinecarbothioamide IUPAC Name: 2-[(6-acetyl-2,3-dimethoxyphenoxy)methyl]-N-(1,3-benzodioxol-5-ylmethyl)morpholine-4-carbothioamide Traditional Name: 2-[(6-acetyl-2,3-dimethoxy-phenoxy)methyl]-N-piperonyl-morpholine-4-carbothioamide Formula: C24H28N2O7S MolecularWeight: 488.55332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(C=C1)OC)OC)OCC2CN(CCO2)C(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=C(C(=C(C=C1)OC)OC)OCC2CN(CCO2)C(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H28N2O7S/c1-15(27)18-5-7-20(28-2)23(29-3)22(18)31-13-17-12-26(8-9-30-17)24(34)25-11-16-4-6-19-21(10-16)33-14-32-19/h4-7,10,17H,8-9,11-14H2,1-3H3,(H,25,34)