Vitas-M small molecule compound
dimethyl 2-({[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)benzene-1,4-dicarboxylate
Catalog ID
STL354615
SMILES COC(=O)c1ccc(cc1NC(=O)CSc1nc(C)cc(=O)[nH]1)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/c1-9-6-13(21)20-17(18-9)27-8-14(22)19-12-7-10(15(23)25-2)4-5-11(12)16(24)26-3/h4-7H,8H2,1-3H3,(H,19,22)(H,18,20,21)InChIKey
KSOJLNGUYGNWJJ-UHFFFAOYSA-NSynonyms
CC1=CC(=O)N=C(N1)SCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC
COC(=O)c1ccc(cc1NC(=O)CSc1nc(C)cc(=O)(nH)1)C(=O)OC
dimethyl2((((4methyl6oxo16dihydropyrimidin2yl)sulfanyl)acetyl)amino)benzene14dicarboxylate
DIMETHYL2((2((6METHYL4OXO1HPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZENE14DICARBOXYLATE
InChI=1SC17H17N3O6Sc19613(21)2017(189)27814(22)1912710(15(23)252)4511(12)16(24)263h47H8H213H3(H1922)(H182021)
MFCD06631740
ZINC000009143501
ZINC9143501
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