N-(3,5-dimethylphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(3,5-dimethylphenyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)C

InChI

InChI=1S/C22H17NO4S/c1-13-9-14(2)11-16(10-13)23-22(25)15-7-8-18-20(12-15)28(26,27)19-6-4-3-5-17(19)21(18)24/h3-12H,1-2H3,(H,23,25)