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

Systemtic Name: 9,10,10-tris(oxidanylidene)-N-pentyl-thioxanthene-3-carboxamide Openeye Name: 9,10,10-trioxo-N-pentyl-thioxanthene-3-carboxamide CAS Name: 9,10,10-trioxo-N-pentyl-3-thioxanthenecarboxamide IUPAC Name: 9,10,10-trioxo-N-pentylthioxanthene-3-carboxamide Traditional Name: N-amyl-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CCCCCNC(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C19H19NO4S/c1-2-3-6-11-20-19(22)13-9-10-15-17(12-13)25(23,24)16-8-5-4-7-14(16)18(15)21/h4-5,7-10,12H,2-3,6,11H2,1H3,(H,20,22)