5-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-1-(2,3-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3,5-ditert-butyl-4-hydroxy-benzylidene)-1-(2,3-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C27H32N2O3S MolecularWeight: 464.61958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C(=O)NC2=S)C

InChI

InChI=1S/C27H32N2O3S/c1-15-10-9-11-21(16(15)2)29-24(32)18(23(31)28-25(29)33)12-17-13-19(26(3,4)5)22(30)20(14-17)27(6,7)8/h9-14,30H,1-8H3,(H,28,31,33)