Vitas-M small molecule compound
methyl 4-[({[5-(acetylamino)-4-hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK209082
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nc(O)c(c(=O)[nH]1)NC(=O)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 C16H16N4O6S MW 392.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O6S/c1-8(21)17-12-13(23)19-16(20-14(12)24)27-7-11(22)18-10-5-3-9(4-6-10)15(25)26-2/h3-6H,7H2,1-2H3,(H,17,21)(H,18,22)(H2,19,20,23,24)InChIKey
RJZNPCGFXWFHHS-UHFFFAOYSA-NSynonyms
824981-17-1824981171
CC(=O)NC1=C(N=C(NC1=O)SCC(=O)NC2=CC=C(C=C2)C(=O)OC)O
COC(=O)c1ccc(cc1)NC(=O)CSc1nc(O)c(c(=O)(nH)1)NC(=O)C
InChI=1SC16H16N4O6Sc18(21)171213(23)1916(2014(12)24)27711(22)1810539(4610)15(25)262h36H7H212H3(H1721)(H1822)(H219202324)
METHYL4((((5(ACETYLAMINO)4HYDROXY6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2((5ACETAMIDO4HYDROXY6OXO1HPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD06623264
ZINC000010034969
ZINC10034969
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