Vitas-M small molecule compound
methyl N-{[4-methyl-2-(1H-pyrrol-1-yl)-1,3-thiazol-5-yl]carbonyl}-beta-alaninate
Catalog ID
STL317671
SMILES COC(=O)CCNC(=O)c1sc(nc1C)n1cccc1
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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 C13H15N3O3S MW 293.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O3S/c1-9-11(12(18)14-6-5-10(17)19-2)20-13(15-9)16-7-3-4-8-16/h3-4,7-8H,5-6H2,1-2H3,(H,14,18)InChIKey
STYYNXRQATVBTE-UHFFFAOYSA-NSynonyms
1401588-12-21401588122
CC1=C(SC(=N1)N2C=CC=C2)C(=O)NCCC(=O)OC
InChI=1SC13H15N3O3Sc1911(12(18)146510(17)192)2013(159)16734816h3478H56H212H3(H1418)
methyl3((4methyl2pyrrol1yl13thiazole5carbonyl)amino)propanoate
methyl3(4methyl2(1Hpyrrol1yl)thiazole5carboxamido)propanoate
methylN((4methyl2(1Hpyrrol1yl)13thiazol5yl)carbonyl)betaalaninate
MFCD22583494
ZINC000079482635
ZINC79482635
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