2-[(6-ethanoyl-2,3-dimethoxy-phenoxy)methyl]-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide

Systemtic Name: 2-[(6-ethanoyl-2,3-dimethoxy-phenoxy)methyl]-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Openeye Name: 2-[(6-acetyl-2,3-dimethoxy-phenoxy)methyl]-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide CAS Name: 2-[(6-acetyl-2,3-dimethoxyphenoxy)methyl]-N-(4-sulfamoylphenyl)-4-morpholinecarbothioamide IUPAC Name: 2-[(6-acetyl-2,3-dimethoxyphenoxy)methyl]-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Traditional Name: 2-[(6-acetyl-2,3-dimethoxy-phenoxy)methyl]-N-(4-sulfamoylphenyl)morpholine-4-carbothioamide Formula: C22H27N3O7S2 MolecularWeight: 509.59568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O7S2/c1-14(26)18-8-9-19(29-2)21(30-3)20(18)32-13-16-12-25(10-11-31-16)22(33)24-15-4-6-17(7-5-15)34(23,27)28/h4-9,16H,10-13H2,1-3H3,(H,24,33)(H2,23,27,28)