N-[5-(diethylsulfamoyl)-2-piperidin-1-yl-phenyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-piperidin-1-yl-phenyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(1-piperidyl)phenyl]-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-(1-piperidinyl)phenyl]-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-piperidin-1-ylphenyl]-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-piperidino-phenyl]-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C29H31N3O6S2 MolecularWeight: 581.70294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C29H31N3O6S2/c1-3-32(4-2)40(37,38)21-13-15-25(31-16-8-5-9-17-31)24(19-21)30-29(34)20-12-14-23-27(18-20)39(35,36)26-11-7-6-10-22(26)28(23)33/h6-7,10-15,18-19H,3-5,8-9,16-17H2,1-2H3,(H,30,34)