N-(1H-benzimidazol-2-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(1H-benzimidazol-2-yl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(1H-benzimidazol-2-yl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(1H-benzimidazol-2-yl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(1H-benzimidazol-2-yl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C21H13N3O4S MolecularWeight: 403.41062

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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=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H13N3O4S/c25-19-13-5-1-4-8-17(13)29(27,28)18-11-12(9-10-14(18)19)20(26)24-21-22-15-6-2-3-7-16(15)23-21/h1-11H,(H2,22,23,24,26)