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3-C-(4-chloro-3-nitrobenzene)-2-N,4,6-trimethyl-2-N-phenylthieno[2,3-b]pyridine-2,3-diamido
SpectraBase Compound ID AKDCNNzybSN
InChI InChI=1S/C24H19ClN4O4S/c1-13-11-14(2)26-23-19(13)20(21(34-23)24(31)28(3)16-7-5-4-6-8-16)27-22(30)15-9-10-17(25)18(12-15)29(32)33/h4-12H,1-3H3,(H,27,30)
InChIKey CZFHXMMMKHXTQV-UHFFFAOYSA-N
Mol Weight 494.95 g/mol
Molecular Formula C24H19ClN4O4S
Exact Mass 494.081554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ek0CxaAmX0E
Name 3-C-(4-chloro-3-nitrobenzene)-2-N,4,6-trimethyl-2-N-phenylthieno[2,3-b]pyridine-2,3-diamido
Alternate Name(s) Thieno[2,3-b]pyridine-2-carboxamide, 3-[(4-chloro-3-nitrobenzoyl)amino]-N,4,6-trimethyl-N-phenyl- 3-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-N,4,6-trimethyl-N-phenyl-2-thieno[2,3-b]pyridinecarboxamide 3-[(4-chloro-3-nitrobenzoyl)amino]-N,4,6-trimethyl-N-phenylthieno[2,3-b]pyridine-2-carboxamide 3-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-N,4,6-trimethyl-N-phenyl-thieno[2,3-b]pyridine-2-carboxamide
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Formula C24H19ClN4O4S
InChI InChI=1S/C24H19ClN4O4S/c1-13-11-14(2)26-23-19(13)20(21(34-23)24(31)28(3)16-7-5-4-6-8-16)27-22(30)15-9-10-17(25)18(12-15)29(32)33/h4-12H,1-3H3,(H,27,30)
InChIKey CZFHXMMMKHXTQV-UHFFFAOYSA-N
Molecular Weight 494.953 g/mol
SMILES N(c1c(sc2nc(C)cc(c12)C)C(N(c1ccccc1)C)=O)C(c1cc(N(=O)=O)c(cc1)Cl)=O
SPLASH splash10-0a5i-1902000000-00ab71852373b9200538
Source of Spectrum IY-2-4984-6
Wiley ID 1657829