N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-cyclopropyl-N-(1,1-dioxothiolan-3-yl)-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-cyclopropyl-N-(1,1-dioxo-3-thiolanyl)-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-cyclopropyl-N-(1,1-dioxothiolan-3-yl)-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-cyclopropyl-N-(1,1-diketothiolan-3-yl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C21H19NO6S2 MolecularWeight: 445.50866

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCS(=O)(=O)C2)C(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

Isomeric SMILES

C1CC1N(C2CCS(=O)(=O)C2)C(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5S4(=O)=O

InChI

InChI=1S/C21H19NO6S2/c23-20-16-3-1-2-4-18(16)30(27,28)19-11-13(5-8-17(19)20)21(24)22(14-6-7-14)15-9-10-29(25,26)12-15/h1-5,8,11,14-15H,6-7,9-10,12H2