N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C23H16N2O4S2 MolecularWeight: 448.51414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O)C#N

InChI

InChI=1S/C23H16N2O4S2/c24-12-17-14-5-1-3-7-18(14)30-23(17)25-22(27)13-9-10-16-20(11-13)31(28,29)19-8-4-2-6-15(19)21(16)26/h2,4,6,8-11H,1,3,5,7H2,(H,25,27)