Vitas-M small molecule compound
ethyl (2E)-3-{3-chloro-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-methoxyphenyl}-2-cyanoprop-2-enoate
Catalog ID
STK060192
SMILES CCOC(=O)/C(=C/c1cc(Cl)c(c(c1)OC)OCCOc1ccc(cc1)C1CCCCC1)/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 C27H30ClNO5 MW 483.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30ClNO5/c1-3-32-27(30)22(18-29)15-19-16-24(28)26(25(17-19)31-2)34-14-13-33-23-11-9-21(10-12-23)20-7-5-4-6-8-20/h9-12,15-17,20H,3-8,13-14H2,1-2H3/b22-15+InChIKey
QBGGLEXGTUEPOO-PXLXIMEGSA-NSynonyms
CCOC(=O)C(=CC1=CC(=C(C(=C1)Cl)OCCOC2=CC=C(C=C2)C3CCCCC3)OC)C#N
CCOC(=O)C(=Cc1cc(Cl)c(c(c1)OC)OCCOc1ccc(cc1)C1CCCCC1)C#N
ETHYL(2E)3(3CHLORO4(2(4CYCLOHEXYLPHENOXY)ETHOXY)5METHOXYPHENYL)2CYANOPROP2ENOATE
ETHYL(E)3(3CHLORO4(2(4CYCLOHEXYLPHENOXY)ETHOXY)5METHOXYPHENYL)2CYANOPROP2ENOATE
InChI=1SC27H30ClNO5c133227(30)22(1829)15191624(28)26(25(1719)312)341413332311921(101223)207546820h912151720H381314H212H3b2215+
MFCD02206835
STK060192
ZINC000013896680
ZINC13896680
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