Vitas-M small molecule compound
ethyl 4-[4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK958973
SMILES N#CCOc1c(I)cc(cc1OCC)C1NC(=O)NC(=C1C(=O)OCC)C
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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 C18H20IN3O5 MW 485.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20IN3O5/c1-4-25-13-9-11(8-12(19)16(13)27-7-6-20)15-14(17(23)26-5-2)10(3)21-18(24)22-15/h8-9,15H,4-5,7H2,1-3H3,(H2,21,22,24)InChIKey
OHBCNQVUGPEUGT-UHFFFAOYSA-NSynonyms
445288-41-5445288415
CCOC1=C(C(=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC)I)OCC#N
ethyl4(4(cyanomethoxy)3ethoxy5iodophenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
ETHYL4(4(CYANOMETHOXY)3ETHOXY5IODOPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC18H20IN3O5c142513911(812(19)16(13)277620)1514(17(23)2652)10(3)2118(24)2215h8915H457H213H3(H2212224)
MFCD02605914
ZINC000008444343
ZINC000008444344
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