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3-C-(2-chlorobenzene)-2-N-(4-ethylphenyl)-4,6-dimethylthieno[2,3-b]pyridine-2,3-diamido
SpectraBase Compound ID 7ktn3z3ce4T
InChI InChI=1S/C25H22ClN3O2S/c1-4-16-9-11-17(12-10-16)28-24(31)22-21(20-14(2)13-15(3)27-25(20)32-22)29-23(30)18-7-5-6-8-19(18)26/h5-13H,4H2,1-3H3,(H,28,31)(H,29,30)
InChIKey LORYIHBHDYQDSL-UHFFFAOYSA-N
Mol Weight 463.98 g/mol
Molecular Formula C25H22ClN3O2S
Exact Mass 463.112126 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4SW1GwWbEe
Name 3-C-(2-chlorobenzene)-2-N-(4-ethylphenyl)-4,6-dimethylthieno[2,3-b]pyridine-2,3-diamido
Alternate Name(s) Thieno[2,3-b]pyridine-2-carboxamide, 3-[(2-chlorobenzoyl)amino]-N-(4-ethylphenyl)-4,6-dimethyl- 3-[[(2-chlorophenyl)-oxomethyl]amino]-N-(4-ethylphenyl)-4,6-dimethyl-2-thieno[2,3-b]pyridinecarboxamide 3-[(2-chlorobenzoyl)amino]-N-(4-ethylphenyl)-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide 3-[(2-chlorophenyl)carbonylamino]-N-(4-ethylphenyl)-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxamide
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Formula C25H22ClN3O2S
InChI InChI=1S/C25H22ClN3O2S/c1-4-16-9-11-17(12-10-16)28-24(31)22-21(20-14(2)13-15(3)27-25(20)32-22)29-23(30)18-7-5-6-8-19(18)26/h5-13H,4H2,1-3H3,(H,28,31)(H,29,30)
InChIKey LORYIHBHDYQDSL-UHFFFAOYSA-N
Molecular Weight 463.983 g/mol
SMILES N(c1c(C(Nc2ccc(cc2)CC)=O)sc2nc(cc(c12)C)C)C(c1c(Cl)cccc1)=O
SPLASH splash10-0079-0900000000-15549c45578d9630458b
Source of Spectrum IY-2-4959-4
Wiley ID 1657577