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Pyrimethamine 2AC
SpectraBase Compound ID 8tMgO86hg6z
InChI InChI=1S/C16H17ClN4O2/c1-4-13-14(11-5-7-12(17)8-6-11)15(18-9(2)22)21-16(20-13)19-10(3)23/h5-8H,4H2,1-3H3,(H2,18,19,20,21,22,23)
InChIKey LLASVMNNSKMLMN-UHFFFAOYSA-N
Mol Weight 332.79 g/mol
Molecular Formula C16H17ClN4O2
Exact Mass 332.104004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ahm9nUmCX7t
Name Pyrimethamine diacetate
CAS Registry Number 71523-78-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17ClN4O2
InChI InChI=1S/C16H17ClN4O2/c1-4-13-14(11-5-7-12(17)8-6-11)15(18-9(2)22)21-16(20-13)19-10(3)23/h5-8H,4H2,1-3H3,(H2,18,19,20,21,22,23)
InChIKey LLASVMNNSKMLMN-UHFFFAOYSA-N
Molecular Weight 332.791 g/mol
SMILES N(c1nc(c(c(n1)NC(C)=O)-c1ccc(cc1)Cl)CC)C(C)=O
SPLASH splash10-0005-0090000000-4caecd93b022aac04d57
Source of Spectrum JZ-1992-874-0
Synonyms N-[2-(Acetylamino)-5-(4-chlorophenyl)-6-ethyl-4-pyrimidinyl]acetamide N-[2-acetamido-5-(4-chlorophenyl)-6-ethyl-4-pyrimidinyl]acetamide N-[2-acetamido-5-(4-chlorophenyl)-6-ethyl-pyrimidin-4-yl]acetamide N-[2-acetamido-5-(4-chlorophenyl)-6-ethyl-pyrimidin-4-yl]ethanamide
Wiley ID 1329174