Vitas-M small molecule compound
dimethyl 5-({[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)benzene-1,3-dicarboxylate
Catalog ID
STK149699
SMILES COC(=O)c1cc(NC(=O)CSc2nc(C)cc(=O)[nH]2)cc(c1)C(=O)OC
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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 C17H17N3O6S MW 391.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O6S/c1-9-4-13(21)20-17(18-9)27-8-14(22)19-12-6-10(15(23)25-2)5-11(7-12)16(24)26-3/h4-7H,8H2,1-3H3,(H,19,22)(H,18,20,21)InChIKey
ACEHGLDUDSPAPV-UHFFFAOYSA-NSynonyms
587006-76-6CC1=CC(=O)N=C(N1)SCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC
COC(=O)c1cc(NC(=O)CSc2nc(C)cc(=O)(nH)2)cc(c1)C(=O)OC
DIMETHYL5((((4HYDROXY6METHYLPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5((((4METHYL6OXO16DIHYDRO2PYRIMIDINYL)THIO)ACETYL)AMINO)ISOPHTHALATE
DIMETHYL5((((4METHYL6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5((2((6METHYL4OXO1HPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZENE13DICARBOXYLATE
dimethyl5(2((4methyl6oxo16dihydropyrimidin2yl)thio)acetamido)isophthalate
InChI=1SC17H17N3O6Sc19413(21)2017(189)27814(22)1912610(15(23)252)511(712)16(24)263h47H8H213H3(H1922)(H182021)
METHYL3(METHOXYCARBONYL)5(2(6METHYL4OXO(3HYDROPYRIMIDIN2YLTHIO))ACETYLAMINO)BENZOATE
MFCD03613003
ZINC18254399
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