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

Systemtic Name: N,N-dibutyl-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N,N-dibutyl-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N,N-dibutyl-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N,N-dibutyl-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N,N-dibutyl-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CCCCN(CCCC)C(=O)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C22H25NO4S/c1-3-5-13-23(14-6-4-2)22(25)16-11-12-18-20(15-16)28(26,27)19-10-8-7-9-17(19)21(18)24/h7-12,15H,3-6,13-14H2,1-2H3