N-[1-(3,4-diethoxyphenyl)ethyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-[1-(3,4-diethoxyphenyl)ethyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-[1-(3,4-diethoxyphenyl)ethyl]-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-[1-(3,4-diethoxyphenyl)ethyl]-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)ethyl]-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-[1-(3,4-diethoxyphenyl)ethyl]-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C26H25NO6S MolecularWeight: 479.5448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O)OCC

InChI

InChI=1S/C26H25NO6S/c1-4-32-21-13-11-17(14-22(21)33-5-2)16(3)27-26(29)18-10-12-20-24(15-18)34(30,31)23-9-7-6-8-19(23)25(20)28/h6-16H,4-5H2,1-3H3,(H,27,29)