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

Systemtic Name: N-(4-fluoranyl-1,3-benzothiazol-2-yl)-9,10,10-tris(oxidanylidene)thioxanthene-2-carboxamide Openeye Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-9,10,10-trioxo-thioxanthene-2-carboxamide CAS Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-9,10,10-trioxo-2-thioxanthenecarboxamide IUPAC Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-9,10,10-trioxothioxanthene-2-carboxamide Traditional Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-9,10,10-triketo-thioxanthene-2-carboxamide Formula: C21H11FN2O4S2 MolecularWeight: 438.451443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=CC(=C3)C(=O)NC4=NC5=C(C=CC=C5S4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=CC(=C3)C(=O)NC4=NC5=C(C=CC=C5S4)F

InChI

InChI=1S/C21H11FN2O4S2/c22-14-5-3-6-15-18(14)23-21(29-15)24-20(26)11-8-9-17-13(10-11)19(25)12-4-1-2-7-16(12)30(17,27)28/h1-10H,(H,23,24,26)