Vitas-M small molecule compound
methyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK397867
SMILES COC(=O)C1=C(C)NC(=S)NC1c1cc(Cl)c(c(c1)OC)O
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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 C14H15ClN2O4S MW 342.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15ClN2O4S/c1-6-10(13(19)21-3)11(17-14(22)16-6)7-4-8(15)12(18)9(5-7)20-2/h4-5,11,18H,1-3H3,(H2,16,17,22)InChIKey
YRQCCWPCASPLGQ-UHFFFAOYSA-NSynonyms
678146-51-5678146515
CC1=C(C(NC(=S)N1)C2=CC(=C(C(=C2)Cl)O)OC)C(=O)OC
InChI=1SC14H15ClN2O4Sc1610(13(19)213)11(1714(22)166)748(15)12(18)9(57)202h451118H13H3(H2161722)
METHYL4(3CHLORO4HYDROXY5METHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
methyl4(3chloro4hydroxy5methoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
MFCD02380031
ZINC000000460910
ZINC000000460911
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