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2-[(3-fluorobenzoyl)amino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester
SpectraBase Compound ID 6dYug5OJUST
InChI InChI=1S/C25H24FN3O5S/c1-3-34-25(32)29-12-11-19-20(14-29)35-24(28-22(30)15-5-4-6-16(26)13-15)21(19)23(31)27-17-7-9-18(33-2)10-8-17/h4-10,13H,3,11-12,14H2,1-2H3,(H,27,31)(H,28,30)
InChIKey ZOCVKJCJOWEEDL-UHFFFAOYSA-N
Mol Weight 497.54 g/mol
Molecular Formula C25H24FN3O5S
Exact Mass 497.14207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2X96nROYj7F
Name 2-[(3-fluorobenzoyl)amino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester
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Formula C25H24FN3O5S
InChI InChI=1S/C25H24FN3O5S/c1-3-34-25(32)29-12-11-19-20(14-29)35-24(28-22(30)15-5-4-6-16(26)13-15)21(19)23(31)27-17-7-9-18(33-2)10-8-17/h4-10,13H,3,11-12,14H2,1-2H3,(H,27,31)(H,28,30)
InChIKey ZOCVKJCJOWEEDL-UHFFFAOYSA-N
Molecular Weight 497.541 g/mol
SMILES N(c1c(C(Nc2ccc(cc2)OC)=O)c2c(s1)CN(CC2)C(=O)OCC)C(c1cc(F)ccc1)=O
SPLASH splash10-00di-3900000000-290b1356ecd9b33ecf91
Synonyms 2-[[(3-fluorophenyl)-oxomethyl]amino]-3-[(4-methoxyanilino)-oxomethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Ethyl 2-[(3-fluorobenzoyl)amino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Ethyl 2-[(3-fluorophenyl)carbonylamino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
Wiley ID 1461429