9,9-diethyl-2-methyl-10,10-bis(oxidanylidene)-N-(1-oxidanyl-1-phenyl-propan-2-yl)thioxanthene-3-sulfonamide

Systemtic Name: 9,9-diethyl-2-methyl-10,10-bis(oxidanylidene)-N-(1-oxidanyl-1-phenyl-propan-2-yl)thioxanthene-3-sulfonamide Openeye Name: 9,9-diethyl-N-(2-hydroxy-1-methyl-2-phenyl-ethyl)-2-methyl-10,10-dioxo-thioxanthene-3-sulfonamide CAS Name: 9,9-diethyl-N-(1-hydroxy-1-phenylpropan-2-yl)-2-methyl-10,10-dioxo-3-thioxanthenesulfonamide IUPAC Name: 9,9-diethyl-N-(1-hydroxy-1-phenylpropan-2-yl)-2-methyl-10,10-dioxothioxanthene-3-sulfonamide Traditional Name: 9,9-diethyl-N-(2-hydroxy-1-methyl-2-phenyl-ethyl)-10,10-diketo-2-methyl-thioxanthene-3-sulfonamide Formula: C27H31NO5S2 MolecularWeight: 513.66874

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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)NC(C)C(C4=CC=CC=C4)O)CC

Isomeric SMILES

CCC1(C2=CC=CC=C2S(=O)(=O)C3=CC(=C(C=C31)C)S(=O)(=O)NC(C)C(C4=CC=CC=C4)O)CC

InChI

InChI=1S/C27H31NO5S2/c1-5-27(6-2)21-14-10-11-15-23(21)34(30,31)25-17-24(18(3)16-22(25)27)35(32,33)28-19(4)26(29)20-12-8-7-9-13-20/h7-17,19,26,28-29H,5-6H2,1-4H3