3-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-oxidanylidene-ethyl]sulfanyl-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-oxidanylidene-ethyl]sulfanyl-2H-1,2,4-triazin-5-one Openeye Name: 3-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-oxo-ethyl]sulfanyl-2H-1,2,4-triazin-5-one CAS Name: 3-[[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]thio]-2H-1,2,4-triazin-5-one IUPAC Name: 3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]sulfanyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[[2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-keto-ethyl]thio]-2H-1,2,4-triazin-5-one Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CSC2=NC(=O)C=NN2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CSC2=NC(=O)C=NN2

InChI

InChI=1S/C19H25N3O3S/c1-18(2,3)12-7-11(8-13(16(12)25)19(4,5)6)14(23)10-26-17-21-15(24)9-20-22-17/h7-9,25H,10H2,1-6H3,(H,21,22,24)