6-(1-benzofuran-2-yl)-N-(2,2-dimethylpropyl)-9,10,10-tris(oxidanylidene)thioxanthene-1-carboxamide

Systemtic Name: 6-(1-benzofuran-2-yl)-N-(2,2-dimethylpropyl)-9,10,10-tris(oxidanylidene)thioxanthene-1-carboxamide Openeye Name: 6-(benzofuran-2-yl)-N-(2,2-dimethylpropyl)-9,10,10-trioxo-thioxanthene-1-carboxamide CAS Name: 6-(2-benzofuranyl)-N-(2,2-dimethylpropyl)-9,10,10-trioxo-1-thioxanthenecarboxamide IUPAC Name: 6-(1-benzofuran-2-yl)-N-(2,2-dimethylpropyl)-9,10,10-trioxothioxanthene-1-carboxamide Traditional Name: 6-(benzofuran-2-yl)-9,10,10-triketo-N-neopentyl-thioxanthene-1-carboxamide Formula: C27H23NO5S MolecularWeight: 473.54022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)C1=C2C(=CC=C1)S(=O)(=O)C3=C(C2=O)C=CC(=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC(C)(C)CNC(=O)C1=C2C(=CC=C1)S(=O)(=O)C3=C(C2=O)C=CC(=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C27H23NO5S/c1-27(2,3)15-28-26(30)19-8-6-10-22-24(19)25(29)18-12-11-17(14-23(18)34(22,31)32)21-13-16-7-4-5-9-20(16)33-21/h4-14H,15H2,1-3H3,(H,28,30)