9,10,10-tris(oxidanylidene)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)thioxanthene-3-carboxamide

Systemtic Name: 9,10,10-tris(oxidanylidene)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)thioxanthene-3-carboxamide Openeye Name: 9,10,10-trioxo-N-[4-(2-pyridyl)thiazol-2-yl]thioxanthene-3-carboxamide CAS Name: 9,10,10-trioxo-N-[4-(2-pyridinyl)-2-thiazolyl]-3-thioxanthenecarboxamide IUPAC Name: 9,10,10-trioxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)thioxanthene-3-carboxamide Traditional Name: 9,10,10-triketo-N-[4-(2-pyridyl)thiazol-2-yl]thioxanthene-3-carboxamide Formula: C22H13N3O4S2 MolecularWeight: 447.48632

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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=NC(=CS4)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NC4=NC(=CS4)C5=CC=CC=N5

InChI

InChI=1S/C22H13N3O4S2/c26-20-14-5-1-2-7-18(14)31(28,29)19-11-13(8-9-15(19)20)21(27)25-22-24-17(12-30-22)16-6-3-4-10-23-16/h1-12H,(H,24,25,27)