Vitas-M small molecule compound
ethyl 2-({[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)-1,3-benzothiazole-6-carboxylate
Catalog ID
STK719996
SMILES CCOC(=O)c1ccc2c(c1)sc(n2)NC(=O)CSc1nc(C)cc(=O)[nH]1
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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 C17H16N4O4S2 MW 404.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O4S2/c1-3-25-15(24)10-4-5-11-12(7-10)27-17(19-11)21-14(23)8-26-16-18-9(2)6-13(22)20-16/h4-7H,3,8H2,1-2H3,(H,18,20,22)(H,19,21,23)InChIKey
KVQDJJUTRJWRCO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC(=O)C=C(N3)C
CCOC(=O)c1ccc2c(c1)sc(n2)NC(=O)CSc1nc(C)cc(=O)(nH)1
ETHYL2((((4METHYL6OXO16DIHYDRO2PYRIMIDINYL)SULFANYL)ACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
ethyl2((((4methyl6oxo16dihydropyrimidin2yl)sulfanyl)acetyl)amino)13benzothiazole6carboxylate
ETHYL2((2((6METHYL4OXO1HPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
InChI=1SC17H16N4O4S2c132515(24)10451112(710)2717(1911)2114(23)82616189(2)613(22)2016h47H38H212H3(H182022)(H192123)
MFCD01305550
ZINC000002969353
ZINC02969353
ZINC2969353
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