N-(4-aminocarbonylphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(4-aminocarbonylphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(4-carbamoylphenyl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(4-carbamoylphenyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(4-carbamoylphenyl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(4-carbamoylphenyl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C21H14N2O5S MolecularWeight: 406.41126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C21H14N2O5S/c22-20(25)12-5-8-14(9-6-12)23-21(26)13-7-10-16-18(11-13)29(27,28)17-4-2-1-3-15(17)19(16)24/h1-11H,(H2,22,25)(H,23,26)