Vitas-M small molecule compound
ethyl (2E)-4-methyl-2-({[6-oxo-3-(thiomorpholin-4-yl)pyridazin-1(6H)-yl]acetyl}imino)-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STL158980
SMILES CCOC(=O)c1s/c(=N/C(=O)Cn2nc(ccc2=O)N2CCSCC2)/[nH]c1C
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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 C17H21N5O4S2 MW 423.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O4S2/c1-3-26-16(25)15-11(2)18-17(28-15)19-13(23)10-22-14(24)5-4-12(20-22)21-6-8-27-9-7-21/h4-5H,3,6-10H2,1-2H3,(H,18,19,23)InChIKey
QXCXLMSWTDRILN-UHFFFAOYSA-NSynonyms
1310945-17-51310945175
CCOC(=O)C1=C(N=C(S1)NC(=O)CN2C(=O)C=CC(=N2)N3CCSCC3)C
CCOC(=O)c1sc(=NC(=O)Cn2nc(ccc2=O)N2CCSCC2)(nH)c1C
ethyl(2E)4methyl2(((6oxo3(thiomorpholin4yl)pyridazin1(6H)yl)acetyl)imino)23dihydro13thiazole5carboxylate
ethyl4methyl2((2(6oxo3thiomorpholin4ylpyridazin1yl)acetyl)amino)13thiazole5carboxylate
InChI=1SC17H21N5O4S2c132616(25)1511(2)1817(2815)1913(23)102214(24)5412(2022)2168279721h45H3610H212H3(H181923)
MFCD20758536
ZINC000071282952
ZINC71282952
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