N-[2-(dimethylamino)-2-phenyl-ethyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-[2-(dimethylamino)-2-phenylethyl]-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-phenylethyl]-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-[2-(dimethylamino)-2-phenyl-ethyl]-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O4S/c1-26(2)20(16-8-4-3-5-9-16)15-25-24(28)17-12-13-19-22(14-17)31(29,30)21-11-7-6-10-18(21)23(19)27/h3-14,20H,15H2,1-2H3,(H,25,28)