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2-[(4-chlorobenzoyl)amino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-[(4-chlorobenzoyl)amino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester
SpectraBase Compound ID EQapBBXOVgK
InChI InChI=1S/C25H24ClN3O5S/c1-3-34-25(32)29-13-12-19-20(14-29)35-24(28-22(30)15-4-6-16(26)7-5-15)21(19)23(31)27-17-8-10-18(33-2)11-9-17/h4-11H,3,12-14H2,1-2H3,(H,27,31)(H,28,30)
InChIKey QWCBOUMGEOUPFY-UHFFFAOYSA-N
Mol Weight 514.0 g/mol
Molecular Formula C25H24ClN3O5S
Exact Mass 513.11252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AL6HrnUQZBX
Name 2-[(4-chlorobenzoyl)amino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24ClN3O5S
InChI InChI=1S/C25H24ClN3O5S/c1-3-34-25(32)29-13-12-19-20(14-29)35-24(28-22(30)15-4-6-16(26)7-5-15)21(19)23(31)27-17-8-10-18(33-2)11-9-17/h4-11H,3,12-14H2,1-2H3,(H,27,31)(H,28,30)
InChIKey QWCBOUMGEOUPFY-UHFFFAOYSA-N
Molecular Weight 513.996 g/mol
SMILES N(c1c(C(Nc2ccc(cc2)OC)=O)c2c(s1)CN(CC2)C(=O)OCC)C(c1ccc(cc1)Cl)=O
SPLASH splash10-00di-1900000000-7b24d41f349927e411c6
Synonyms 2-[[(4-chlorophenyl)-oxomethyl]amino]-3-[(4-methoxyanilino)-oxomethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Ethyl 2-[(4-chlorobenzoyl)amino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Ethyl 2-[(4-chlorophenyl)carbonylamino]-3-[(4-methoxyphenyl)carbamoyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate
Wiley ID 1460176