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2-(3-Chloro-benzoylamino)-3,3,3-trifluoro-2-(5-methyl-thiazol-2-ylamino)-propionic acid methyl ester
SpectraBase Compound ID 1QLzyMYgPu6
InChI InChI=1S/C15H13ClF3N3O3S/c1-8-7-20-13(26-8)22-14(12(24)25-2,15(17,18)19)21-11(23)9-4-3-5-10(16)6-9/h3-7H,1-2H3,(H,20,22)(H,21,23)
InChIKey MBPOIUHGUCSIEF-UHFFFAOYSA-N
Mol Weight 407.8 g/mol
Molecular Formula C15H13ClF3N3O3S
Exact Mass 407.031825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iv6NqnIzrg5
Name 2-(3-Chloro-benzoylamino)-3,3,3-trifluoro-2-(5-methyl-thiazol-2-ylamino)-propionic acid methyl ester
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Formula C15H13ClF3N3O3S
InChI InChI=1S/C15H13ClF3N3O3S/c1-8-7-20-13(26-8)22-14(12(24)25-2,15(17,18)19)21-11(23)9-4-3-5-10(16)6-9/h3-7H,1-2H3,(H,20,22)(H,21,23)
InChIKey MBPOIUHGUCSIEF-UHFFFAOYSA-N
Molecular Weight 407.795 g/mol
SMILES N(C(Nc1ncc(s1)C)(C(F)(F)F)C(=O)OC)C(c1cc(Cl)ccc1)=O
SPLASH splash10-0f72-2839300000-aa0aa94a3313fd9fb2c7
Synonyms 2-[[(3-chlorophenyl)-oxomethyl]amino]-3,3,3-trifluoro-2-[(5-methyl-2-thiazolyl)amino]propanoic acid methyl ester Methyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-[(5-methyl-1,3-thiazol-2-yl)amino]propanoate Methyl 2-[(3-chlorobenzoyl)amino]-3,3,3-trifluoro-2-[(5-methylthiazol-2-yl)amino]propanoate Methyl 2-[(3-chlorophenyl)carbonylamino]-3,3,3-tris(fluoranyl)-2-[(5-methyl-1,3-thiazol-2-yl)amino]propanoate
Wiley ID 1465560