5-Pyrimidinecarboxylic acid, 4-amino-2-[[2-[(2,4-difluorophenyl)amino]-2-oxoethyl]thio]-, ethyl ester

SpectraBase Compound ID	CEEubJODoaI
InChI	InChI=1S/C15H14F2N4O3S/c1-2-24-14(23)9-6-19-15(21-13(9)18)25-7-12(22)20-11-4-3-8(16)5-10(11)17/h3-6H,2,7H2,1H3,(H,20,22)(H2,18,19,21)
InChIKey	LXLXQSNGTMSEBW-UHFFFAOYSA-N Google Search
Mol Weight	368.36 g/mol
Molecular Formula	C15H14F2N4O3S
Exact Mass	368.075468 g/mol

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SpectraBase Spectrum ID	LY1AJZyu6II
Name	5-Pyrimidinecarboxylic acid, 4-amino-2-[[2-[(2,4-difluorophenyl)amino]-2-oxoethyl]thio]-, ethyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H14F2N4O3S
InChI	InChI=1S/C15H14F2N4O3S/c1-2-24-14(23)9-6-19-15(21-13(9)18)25-7-12(22)20-11-4-3-8(16)5-10(11)17/h3-6H,2,7H2,1H3,(H,20,22)(H2,18,19,21)
InChIKey	LXLXQSNGTMSEBW-UHFFFAOYSA-N
Molecular Weight	368.359 g/mol
SMILES	N(C(CSc1nc(c(cn1)C(=O)OCC)N)=O)c1c(cc(cc1)F)F
SPLASH	splash10-0006-4980000000-6a078ac2f023f4f08c17
Synonyms	4-Amino-2-[[2-(2,4-difluoroanilino)-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester 4-Amino-2-[[2-(2,4-difluoroanilino)-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester Ethyl 4-amino-2-[2-(2,4-difluoroanilino)-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate Ethyl 4-azanyl-2-[2-[[2,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate
Wiley ID	1448601