9,9-diethyl-2-methyl-N-(oxan-4-ylmethyl)-10,10-bis(oxidanylidene)thioxanthene-3-sulfonamide

Systemtic Name: 9,9-diethyl-2-methyl-N-(oxan-4-ylmethyl)-10,10-bis(oxidanylidene)thioxanthene-3-sulfonamide Openeye Name: 9,9-diethyl-2-methyl-10,10-dioxo-N-(tetrahydropyran-4-ylmethyl)thioxanthene-3-sulfonamide CAS Name: 9,9-diethyl-2-methyl-N-(4-oxanylmethyl)-10,10-dioxo-3-thioxanthenesulfonamide IUPAC Name: 9,9-diethyl-2-methyl-N-(oxan-4-ylmethyl)-10,10-dioxothioxanthene-3-sulfonamide Traditional Name: 9,9-diethyl-10,10-diketo-2-methyl-N-(tetrahydropyran-4-ylmethyl)thioxanthene-3-sulfonamide Formula: C24H31NO5S2 MolecularWeight: 477.63664

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC=CC=C2S(=O)(=O)C3=CC(=C(C=C31)C)S(=O)(=O)NCC4CCOCC4)CC

Isomeric SMILES

CCC1(C2=CC=CC=C2S(=O)(=O)C3=CC(=C(C=C31)C)S(=O)(=O)NCC4CCOCC4)CC

InChI

InChI=1S/C24H31NO5S2/c1-4-24(5-2)19-8-6-7-9-21(19)31(26,27)23-15-22(17(3)14-20(23)24)32(28,29)25-16-18-10-12-30-13-11-18/h6-9,14-15,18,25H,4-5,10-13,16H2,1-3H3