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N-(4-chlorophenyl)-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfonyl)propanamide
SpectraBase Compound ID EFwgqwLzUQJ
InChI InChI=1S/C16H16ClN5O3S/c1-9-8-10(2)22-15(18-9)20-16(21-22)26(24,25)11(3)14(23)19-13-6-4-12(17)5-7-13/h4-8,11H,1-3H3,(H,19,23)
InChIKey LBDHHDIQGZREFP-UHFFFAOYSA-N
Mol Weight 393.85 g/mol
Molecular Formula C16H16ClN5O3S
Exact Mass 393.066238 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5uudCjh1Hp
Name N-(4-chlorophenyl)-2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylsulfonyl)propanamide
Alternate Name(s) N-(4-chlorophenyl)-2-((5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfonyl)propanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16ClN5O3S
InChI InChI=1S/C16H16ClN5O3S/c1-9-8-10(2)22-15(18-9)20-16(21-22)26(24,25)11(3)14(23)19-13-6-4-12(17)5-7-13/h4-8,11H,1-3H3,(H,19,23)
InChIKey LBDHHDIQGZREFP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.1075
Molecular Weight 393.849 g/mol
SMILES N(C(C(S(=O)(=O)c1nc2N=C(C=C([n]2n1)C)C)C)=O)c1ccc(cc1)Cl
SPLASH splash10-06di-5941000000-85915f3c710c60ce11fe
Source of Spectrum HAC-12-494-4f
Wiley ID 1783376