Vitas-M small molecule compound
ethyl (2E)-2-({[5-(ethoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]carbonyl}imino)-4-methyl-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STL319004
SMILES CCOC(=O)c1[nH]c(c(c1C)C(=O)/N=c\1/sc(c([nH]1)C)C(=O)OCC)C
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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 C17H21N3O5S MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O5S/c1-6-24-15(22)12-8(3)11(9(4)18-12)14(21)20-17-19-10(5)13(26-17)16(23)25-7-2/h18H,6-7H2,1-5H3,(H,19,20,21)InChIKey
AHEUMNNEVMSQEB-UHFFFAOYSA-NSynonyms
1574517-00-21574517002
CCOC(=O)c1(nH)c(c(c1C)C(=O)N=c1sc(c((nH)1)C)C(=O)OCC)C
CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2=NC(=C(S2)C(=O)OCC)C)C
ethyl(2E)2(((5(ethoxycarbonyl)24dimethyl1Hpyrrol3yl)carbonyl)imino)4methyl23dihydro13thiazole5carboxylate
ethyl2((5ethoxycarbonyl24dimethyl1Hpyrrole3carbonyl)amino)4methyl13thiazole5carboxylate
InChI=1SC17H21N3O5Sc162415(22)128(3)11(9(4)1812)14(21)20171910(5)13(2617)16(23)2572h18H67H215H3(H192021)
MFCD28031610
ZINC000015608166
ZINC15608166
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