Vitas-M small molecule compound
ethyl (2Z)-2-[1-(2-amino-1-cyano-2-oxoethyl)cyclohexyl]-3-hydroxybut-2-enoate
Catalog ID
STK523284
SMILES CCOC(=O)/C(=C(\O)/C)/C1(CCCCC1)C(C(=O)N)C#N
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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 C15H22N2O4 MW 294.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N2O4/c1-3-21-14(20)12(10(2)18)15(7-5-4-6-8-15)11(9-16)13(17)19/h11,18H,3-8H2,1-2H3,(H2,17,19)/b12-10+InChIKey
TVDHACHZCHYWBM-ZRDIBKRKSA-NSynonyms
CCOC(=O)C(=C(C)O)C1(CCCCC1)C(C#N)C(=O)N
CCOC(=O)C(=C(O)C)C1(CCCCC1)C(C(=O)N)C#N
ETHYL(2Z)2((CARBAMOYLCYANOMETHYL)CYCLOHEXYL)3HYDROXYBUT2ENOATE
ethyl(2Z)2(1(2amino1cyano2oxoethyl)cyclohexyl)3hydroxybut2enoate
ethyl(Z)2(1(2amino1cyano2oxoethyl)cyclohexyl)3hydroxybut2enoate
InChI=1SC15H22N2O4c132114(20)12(10(2)18)15(7546815)11(916)13(17)19h1118H38H212H3(H21719)b1210+
MFCD02647579
ZINC000100096922
ZINC000100096923
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