Vitas-M small molecule compound

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

Catalog ID
STL311733
SMILES CCCc1nc(sc1C(=O)NCCC(=O)OC)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 C15H19N3O3S MW 321.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N3O3S/c1-3-6-11-13(14(20)16-8-7-12(19)21-2)22-15(17-11)18-9-4-5-10-18/h4-5,9-10H,3,6-8H2,1-2H3,(H,16,20)
InChIKey
DPBUDFZMUITGJX-UHFFFAOYSA-N
Synonyms
1401584-47-1
1401584471
CCCC1=C(SC(=N1)N2C=CC=C2)C(=O)NCCC(=O)OC
InChI=1SC15H19N3O3Sc1361113(14(20)168712(19)212)2215(1711)189451018h45910H368H212H3(H1620)
methyl3((4propyl2pyrrol1yl13thiazole5carbonyl)amino)propanoate
methyl3(4propyl2(1Hpyrrol1yl)thiazole5carboxamido)propanoate
methylN((4propyl2(1Hpyrrol1yl)13thiazol5yl)carbonyl)betaalaninate
MFCD22584662
ZINC000079488644
ZINC79488644

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Available files

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