Vitas-M small molecule compound

methyl N-{[2-(2,6-dichlorophenyl)-4-methyl-1,3-thiazol-5-yl]carbonyl}-beta-alaninate

Catalog ID
STL422480
SMILES COC(=O)CCNC(=O)c1sc(nc1C)c1c(Cl)cccc1Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C15H14Cl2N2O3S MW 373.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14Cl2N2O3S/c1-8-13(14(21)18-7-6-11(20)22-2)23-15(19-8)12-9(16)4-3-5-10(12)17/h3-5H,6-7H2,1-2H3,(H,18,21)
InChIKey
BCNICRVLOARJGB-UHFFFAOYSA-N
Synonyms
1630853-27-8
1630853278
CC1=C(SC(=N1)C2=C(C=CC=C2Cl)Cl)C(=O)NCCC(=O)OC
InChI=1SC15H14Cl2N2O3Sc1813(14(21)187611(20)222)2315(198)129(16)43510(12)17h35H67H212H3(H1821)
methyl3((2(26dichlorophenyl)4methyl13thiazole5carbonyl)amino)propanoate
methyl3(2(26dichlorophenyl)4methylthiazole5carboxamido)propanoate
methylN((2(26dichlorophenyl)4methyl13thiazol5yl)carbonyl)betaalaninate
MFCD28366649
ZINC000218130379
ZINC218130379

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.