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2-(2,4-Dichloro-benzoylamino)-3,3,3-trifluoro-2-(4-methyl-thiazol-2-ylamino)-propionic acid methyl ester
SpectraBase Compound ID BV1YA6tLf8z
InChI InChI=1S/C15H12Cl2F3N3O3S/c1-7-6-27-13(21-7)23-14(12(25)26-2,15(18,19)20)22-11(24)9-4-3-8(16)5-10(9)17/h3-6H,1-2H3,(H,21,23)(H,22,24)
InChIKey LPPIIVNZHNOVOX-UHFFFAOYSA-N
Mol Weight 442.24 g/mol
Molecular Formula C15H12Cl2F3N3O3S
Exact Mass 440.992852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6eJ6uXd1y8
Name 2-(2,4-Dichloro-benzoylamino)-3,3,3-trifluoro-2-(4-methyl-thiazol-2-ylamino)-propionic acid methyl ester
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Formula C15H12Cl2F3N3O3S
InChI InChI=1S/C15H12Cl2F3N3O3S/c1-7-6-27-13(21-7)23-14(12(25)26-2,15(18,19)20)22-11(24)9-4-3-8(16)5-10(9)17/h3-6H,1-2H3,(H,21,23)(H,22,24)
InChIKey LPPIIVNZHNOVOX-UHFFFAOYSA-N
Molecular Weight 442.240 g/mol
SMILES N(C(Nc1nc(C)cs1)(C(F)(F)F)C(=O)OC)C(c1c(cc(cc1)Cl)Cl)=O
SPLASH splash10-00fr-1911000000-d65a47c37ef8627922ca
Synonyms 2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-3,3,3-trifluoro-2-[(4-methyl-2-thiazolyl)amino]propanoic acid methyl ester Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methylthiazol-2-yl)amino]propanoate Methyl 2-[(2,4-dichlorophenyl)carbonylamino]-3,3,3-tris(fluoranyl)-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate
Wiley ID 1462151