N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: 9,10,10-triketo-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thioxanthene-3-carboxamide Formula: C25H19N3O5S MolecularWeight: 473.50046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C25H19N3O5S/c1-15-22(25(31)28(27(15)2)17-8-4-3-5-9-17)26-24(30)16-12-13-19-21(14-16)34(32,33)20-11-7-6-10-18(20)23(19)29/h3-14H,1-2H3,(H,26,30)