9,9-diethyl-N-(2-hydroxyethyl)-2-methyl-10,10-bis(oxidanylidene)thioxanthene-3-sulfonamide

Systemtic Name: 9,9-diethyl-N-(2-hydroxyethyl)-2-methyl-10,10-bis(oxidanylidene)thioxanthene-3-sulfonamide Openeye Name: 9,9-diethyl-N-(2-hydroxyethyl)-2-methyl-10,10-dioxo-thioxanthene-3-sulfonamide CAS Name: 9,9-diethyl-N-(2-hydroxyethyl)-2-methyl-10,10-dioxo-3-thioxanthenesulfonamide IUPAC Name: 9,9-diethyl-N-(2-hydroxyethyl)-2-methyl-10,10-dioxothioxanthene-3-sulfonamide Traditional Name: 9,9-diethyl-N-(2-hydroxyethyl)-10,10-diketo-2-methyl-thioxanthene-3-sulfonamide Formula: C20H25NO5S2 MolecularWeight: 423.5462

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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)NCCO)CC

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO5S2/c1-4-20(5-2)15-8-6-7-9-17(15)27(23,24)19-13-18(14(3)12-16(19)20)28(25,26)21-10-11-22/h6-9,12-13,21-22H,4-5,10-11H2,1-3H3