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

Systemtic Name: 5-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-1,3-diphenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3,5-ditert-butyl-4-hydroxy-benzylidene)-1,3-diphenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C31H32N2O3S MolecularWeight: 512.66238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H32N2O3S/c1-30(2,3)24-18-20(19-25(26(24)34)31(4,5)6)17-23-27(35)32(21-13-9-7-10-14-21)29(37)33(28(23)36)22-15-11-8-12-16-22/h7-19,34H,1-6H3