Vitas-M small molecule compound
methyl 4-({2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate
Catalog ID
STK274506
SMILES COc1nc([nH]c(=O)c1)SC(C(=O)Nc1ccc(cc1)C(=O)OC)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 C16H17N3O5S MW 363.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O5S/c1-9(25-16-18-12(20)8-13(19-16)23-2)14(21)17-11-6-4-10(5-7-11)15(22)24-3/h4-9H,1-3H3,(H,17,21)(H,18,19,20)InChIKey
JIJHRLIWKGXRAW-UHFFFAOYSA-NSynonyms
879060-72-7879060727
CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)SC2=NC(=CC(=O)N2)OC
COc1nc((nH)c(=O)c1)SC(C(=O)Nc1ccc(cc1)C(=O)OC)C
InChI=1SC16H17N3O5Sc19(25161812(20)813(1916)232)14(21)17116410(5711)15(22)243h49H13H3(H1721)(H181920)
methyl4((2((4methoxy6oxo16dihydropyrimidin2yl)sulfanyl)propanoyl)amino)benzoate
METHYL4(2((4METHOXY6OXO1HPYRIMIDIN2YL)SULFANYL)PROPANOYLAMINO)BENZOATE
MFCD07792510
ZINC000004999461
ZINC000004999462
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