N-(1-methylpyrazol-3-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-(1-methylpyrazol-3-yl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-(1-methyl-3-pyrazolyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-(1-methylpyrazol-3-yl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: 9,10,10-triketo-N-(1-methylpyrazol-3-yl)thioxanthene-3-carboxamide Formula: C18H13N3O4S MolecularWeight: 367.37852

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CN1C=CC(=N1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C18H13N3O4S/c1-21-9-8-16(20-21)19-18(23)11-6-7-13-15(10-11)26(24,25)14-5-3-2-4-12(14)17(13)22/h2-10H,1H3,(H,19,20,23)