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3-C-(4-tert-butylbenzene)-2-N,4,6-trimethyl-2-N-phenylthieno[2,3-b]pyridine-2,3-diamido
SpectraBase Compound ID Llc3XQt9a0u
InChI InChI=1S/C28H29N3O2S/c1-17-16-18(2)29-26-22(17)23(24(34-26)27(33)31(6)21-10-8-7-9-11-21)30-25(32)19-12-14-20(15-13-19)28(3,4)5/h7-16H,1-6H3,(H,30,32)
InChIKey VYBVOHZNJXYUIM-UHFFFAOYSA-N
Mol Weight 471.62 g/mol
Molecular Formula C28H29N3O2S
Exact Mass 471.198048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jq0PtsZu2vT
Name 3-C-(4-tert-butylbenzene)-2-N,4,6-trimethyl-2-N-phenylthieno[2,3-b]pyridine-2,3-diamido
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Formula C28H29N3O2S
InChI InChI=1S/C28H29N3O2S/c1-17-16-18(2)29-26-22(17)23(24(34-26)27(33)31(6)21-10-8-7-9-11-21)30-25(32)19-12-14-20(15-13-19)28(3,4)5/h7-16H,1-6H3,(H,30,32)
InChIKey VYBVOHZNJXYUIM-UHFFFAOYSA-N
Molecular Weight 471.619 g/mol
SMILES N(c1c(sc2nc(C)cc(c12)C)C(N(c1ccccc1)C)=O)C(c1ccc(C(C)(C)C)cc1)=O
SPLASH splash10-03xr-1904100000-3330c22fe9bc2bd70e7b
Source of Spectrum IY-2-5063-3
Synonyms Thieno[2,3-b]pyridine-2-carboxamide, 3-[[4-(1,1-dimethylethyl)benzoyl]amino]-N,4,6-trimethyl-N-phenyl- 3-[[(4-tert-butylphenyl)-oxomethyl]amino]-N,4,6-trimethyl-N-phenyl-2-thieno[2,3-b]pyridinecarboxamide 3-[(4-tert-butylbenzoyl)amino]-N,4,6-trimethyl-N-phenylthieno[2,3-b]pyridine-2-carboxamide 3-[(4-tert-butylphenyl)carbonylamino]-N,4,6-trimethyl-N-phenyl-thieno[2,3-b]pyridine-2-carboxamide
Wiley ID 1658616