N-(4-methylphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(4-methylphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: 9,10,10-trioxo-N-(p-tolyl)thioxanthene-3-carboxamide CAS Name: N-(4-methylphenyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(4-methylphenyl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: 9,10,10-triketo-N-(p-tolyl)thioxanthene-3-carboxamide Formula: C21H15NO4S MolecularWeight: 377.4131

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15NO4S/c1-13-6-9-15(10-7-13)22-21(24)14-8-11-17-19(12-14)27(25,26)18-5-3-2-4-16(18)20(17)23/h2-12H,1H3,(H,22,24)