Vitas-M small molecule compound
ethyl 4-(2-bromo-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK522066
SMILES CCOC(=O)C1=C(C)NC(=O)NC1c1cc(OCC)c(cc1Br)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 C16H19BrN2O5 MW 399.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN2O5/c1-4-23-12-6-9(10(17)7-11(12)20)14-13(15(21)24-5-2)8(3)18-16(22)19-14/h6-7,14,20H,4-5H2,1-3H3,(H2,18,19,22)InChIKey
JXKPELVSQRSHES-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C(=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC)Br)O
ethyl4(2bromo5ethoxy4hydroxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
ETHYL4(2BROMO5ETHOXY4HYDROXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC16H19BrN2O5c14231269(10(17)711(12)20)1413(15(21)2452)8(3)1816(22)1914h671420H45H213H3(H2181922)
MFCD05994406
ZINC000001124193
ZINC000001124195
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