Vitas-M small molecule compound
ethyl 6-(3-hydroxy-4-methoxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
Catalog ID
STK561608
SMILES CCOC(=O)C1=C(C)N=C(NC1c1ccc(c(c1)O)OC)S
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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 C15H18N2O4S MW 322.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O4S/c1-4-21-14(19)12-8(2)16-15(22)17-13(12)9-5-6-11(20-3)10(18)7-9/h5-7,13,18H,4H2,1-3H3,(H2,16,17,22)InChIKey
NJICFSFGSZPETL-UHFFFAOYSA-NSynonyms
313526-18-0313526180
CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)OC)O)C
ETHYL4(3HYDROXY4METHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl6(3hydroxy4methoxyphenyl)4methyl2sulfanyl16dihydropyrimidine5carboxylate
InChI=1SC15H18N2O4Sc142114(19)128(2)1615(22)1713(12)95611(203)10(18)79h571318H4H213H3(H2161722)
MFCD03813256
ZINC000001250775
ZINC000001250776
ZINC00190601
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