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

Systemtic Name: N-(4-tert-butylphenyl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(4-tert-butylphenyl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(4-tert-butylphenyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(4-tert-butylphenyl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C24H21NO4S MolecularWeight: 419.49284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21NO4S/c1-24(2,3)16-9-11-17(12-10-16)25-23(27)15-8-13-19-21(14-15)30(28,29)20-7-5-4-6-18(20)22(19)26/h4-14H,1-3H3,(H,25,27)