Vitas-M small molecule compound
ethyl 2-{[5-cyano-4-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}propanoate
Catalog ID
STK274473
SMILES CCOC(=O)C(Sc1nc(c2ccc(cc2)OC)c(c(=O)[nH]1)C#N)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 C17H17N3O4S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S/c1-4-24-16(22)10(2)25-17-19-14(13(9-18)15(21)20-17)11-5-7-12(23-3)8-6-11/h5-8,10H,4H2,1-3H3,(H,19,20,21)InChIKey
PINDRGDWTAEMKF-UHFFFAOYSA-NSynonyms
CCOC(=O)C(C)SC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)OC)C#N
CCOC(=O)C(Sc1nc(c2ccc(cc2)OC)c(c(=O)(nH)1)C#N)C
ETHYL(2R)2((5CYANO6(4METHOXYPHENYL)4OXO14DIHYDROPYRIMIDIN2YL)SULFANYL)PROPANOATE
ETHYL(2S)2((5CYANO6(4METHOXYPHENYL)4OXO14DIHYDROPYRIMIDIN2YL)SULFANYL)PROPANOATE
ETHYL2((5CYANO4(4METHOXYPHENYL)6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)PROPANOATE
ETHYL2((5CYANO6(4METHOXYPHENYL)4OXO1HPYRIMIDIN2YL)SULFANYL)PROPANOATE
InChI=1SC17H17N3O4Sc142416(22)10(2)25171914(13(918)15(21)2017)115712(233)8611h5810H4H213H3(H192021)
MFCD05996578
ZINC000018247554
ZINC000018247556
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Check stock on Vitas-MAvailable files
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