9,10,10-tris(oxidanylidene)-N-(3-propan-2-yloxypropyl)thioxanthene-3-carboxamide

Systemtic Name: 9,10,10-tris(oxidanylidene)-N-(3-propan-2-yloxypropyl)thioxanthene-3-carboxamide Openeye Name: N-(3-isopropoxypropyl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: 9,10,10-trioxo-N-(3-propan-2-yloxypropyl)-3-thioxanthenecarboxamide IUPAC Name: 9,10,10-trioxo-N-(3-propan-2-yloxypropyl)thioxanthene-3-carboxamide Traditional Name: N-(3-isopropoxypropyl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO5S/c1-13(2)26-11-5-10-21-20(23)14-8-9-16-18(12-14)27(24,25)17-7-4-3-6-15(17)19(16)22/h3-4,6-9,12-13H,5,10-11H2,1-2H3,(H,21,23)