6-[[2,4-dimethyl-3-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]methyl]-1,3-thiazinane-2,4-dione

Systemtic Name: 6-[[2,4-dimethyl-3-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]methyl]-1,3-thiazinane-2,4-dione Openeye Name: 6-[[3-(4-hydroxy-3-isopropyl-phenoxy)-2,4-dimethyl-phenyl]methyl]-1,3-thiazinane-2,4-dione CAS Name: 6-[[3-(4-hydroxy-3-propan-2-ylphenoxy)-2,4-dimethylphenyl]methyl]-1,3-thiazinane-2,4-dione IUPAC Name: 6-[[3-(4-hydroxy-3-propan-2-ylphenoxy)-2,4-dimethylphenyl]methyl]-1,3-thiazinane-2,4-dione Traditional Name: 6-[3-(4-hydroxy-3-isopropyl-phenoxy)-2,4-dimethyl-benzyl]-1,3-thiazinane-2,4-quinone Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)CC2CC(=O)NC(=O)S2)C)OC3=CC(=C(C=C3)O)C(C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)CC2CC(=O)NC(=O)S2)C)OC3=CC(=C(C=C3)O)C(C)C

InChI

InChI=1S/C22H25NO4S/c1-12(2)18-10-16(7-8-19(18)24)27-21-13(3)5-6-15(14(21)4)9-17-11-20(25)23-22(26)28-17/h5-8,10,12,17,24H,9,11H2,1-4H3,(H,23,25,26)