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

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)phenyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)phenyl]-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-[2-(1H-benzimidazol-2-yl)phenyl]-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)phenyl]-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)phenyl]-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C27H17N3O4S MolecularWeight: 479.50658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)NC(=O)C4=CC5=C(C=C4)C(=O)C6=CC=CC=C6S5(=O)=O

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)NC(=O)C4=CC5=C(C=C4)C(=O)C6=CC=CC=C6S5(=O)=O

InChI

InChI=1S/C27H17N3O4S/c31-25-18-8-2-6-12-23(18)35(33,34)24-15-16(13-14-19(24)25)27(32)30-20-9-3-1-7-17(20)26-28-21-10-4-5-11-22(21)29-26/h1-15H,(H,28,29)(H,30,32)