Vitas-M small molecule compound
3,4,4-trichlorobut-3-en-2-yl 4-[(2,4-dimethoxypyrimidin-5-yl)amino]-4-oxobutanoate
Catalog ID
STK758392
SMILES COc1nc(OC)ncc1NC(=O)CCC(=O)OC(C(=C(Cl)Cl)Cl)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 C14H16Cl3N3O5 MW 412.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16Cl3N3O5/c1-7(11(15)12(16)17)25-10(22)5-4-9(21)19-8-6-18-14(24-3)20-13(8)23-2/h6-7H,4-5H2,1-3H3,(H,19,21)InChIKey
CQONLQLBQYMUQC-UHFFFAOYSA-NSynonyms
233TRICHLORO1METHYLPROP2ENYL3(N(24DIMETHOXYPYRIMIDIN5YL)CARBAMOYL)PROPANOATE
344trichlorobut3en2yl4((24dimethoxypyrimidin5yl)amino)4oxobutanoate
CC(C(=C(Cl)Cl)Cl)OC(=O)CCC(=O)NC1=CN=C(N=C1OC)OC
InChI=1SC14H16Cl3N3O5c17(11(15)12(16)17)2510(22)549(21)19861814(243)2013(8)232h67H45H213H3(H1921)
MFCD02646536
ZINC000004491647
ZINC000004491649
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