Vitas-M small molecule compound
methyl (2E)-2-{[2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanoyl]imino}-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL312492
SMILES COC(=O)c1[nH]/c(=N\C(=O)C(n2nnc3c(c2=O)cccc3)C)/sc1C(C)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 C18H19N5O4S MW 401.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5O4S/c1-9(2)14-13(17(26)27-4)19-18(28-14)20-15(24)10(3)23-16(25)11-7-5-6-8-12(11)21-22-23/h5-10H,1-4H3,(H,19,20,24)InChIKey
MXSXBPHRXFNYMD-UHFFFAOYSA-NSynonyms
COC(=O)c1(nH)c(=NC(=O)C(n2nnc3c(c2=O)cccc3)C)sc1C(C)C
InChI=1SC18H19N5O4Sc19(2)1413(17(26)274)1918(2814)2015(24)10(3)2316(25)11756812(11)212223h510H14H3(H192024)
methyl(2E)2((2(4oxo123benzotriazin3(4H)yl)propanoyl)imino)5(propan2yl)23dihydro13thiazole4carboxylate
methyl2(2(4oxo123benzotriazin3yl)propanoylamino)5propan2yl13thiazole4carboxylate
MFCD28026688
ZINC000095474836
ZINC000095474837
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Check stock on Vitas-MAvailable files
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