Vitas-M small molecule compound
ethyl 6-methyl-4-{4-[2-oxo-2-(piperidin-1-yl)ethoxy]phenyl}-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK754604
SMILES CCOC(=O)C1=C(C)NC(=S)NC1c1ccc(cc1)OCC(=O)N1CCCCC1
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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 C21H27N3O4S MW 417.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O4S/c1-3-27-20(26)18-14(2)22-21(29)23-19(18)15-7-9-16(10-8-15)28-13-17(25)24-11-5-4-6-12-24/h7-10,19H,3-6,11-13H2,1-2H3,(H2,22,23,29)InChIKey
PVKDUZMZISXSJI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)OCC(=O)N3CCCCC3)C
ethyl6methyl4(4(2oxo2(piperidin1yl)ethoxy)phenyl)2thioxo1234tetrahydropyrimidine5carboxylate
ETHYL6METHYL4(4(2OXO2PIPERIDIN1YLETHOXY)PHENYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC21H27N3O4Sc132720(26)1814(2)2221(29)2319(18)157916(10815)281317(25)24115461224h71019H361113H212H3(H2222329)
MFCD00826195
ZINC000000713066
ZINC000000713068
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