Vitas-M small molecule compound
ethyl 4-{3-methoxy-4-[2-(morpholin-4-yl)-2-oxoethoxy]phenyl}-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK751351
SMILES CCOC(=O)C1=C(C)NC(=S)NC1c1ccc(c(c1)OC)OCC(=O)N1CCOCC1
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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 C21H27N3O6S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O6S/c1-4-29-20(26)18-13(2)22-21(31)23-19(18)14-5-6-15(16(11-14)27-3)30-12-17(25)24-7-9-28-10-8-24/h5-6,11,19H,4,7-10,12H2,1-3H3,(H2,22,23,31)InChIKey
NICMUECLWBKVFD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)OCC(=O)N3CCOCC3)OC)C
ethyl4(3methoxy4(2(morpholin4yl)2oxoethoxy)phenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
ETHYL4(3METHOXY4(2MORPHOLIN4YL2OXOETHOXY)PHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ETHYL6(3METHOXY4(2MORPHOLIN4YL2OXOETHOXY)PHENYL)4METHYL2THIOXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC21H27N3O6Sc142920(26)1813(2)2221(31)2319(18)145615(16(1114)273)301217(25)24792810824h561119H471012H213H3(H2222331)
MFCD00469885
ZINC000000712484
ZINC000000712485
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