Vitas-M small molecule compound
ethyl (2E)-3-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-methoxyphenyl}-2-cyanoprop-2-enoate
Catalog ID
STK153952
SMILES CCOC(=O)/C(=C/c1ccc(c(c1)OC)OCCOc1ccc(cc1)C(C)(C)C)/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 C25H29NO5 MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO5/c1-6-29-24(27)19(17-26)15-18-7-12-22(23(16-18)28-5)31-14-13-30-21-10-8-20(9-11-21)25(2,3)4/h7-12,15-16H,6,13-14H2,1-5H3/b19-15+InChIKey
CFIPCOZYGZMCHQ-XDJHFCHBSA-NSynonyms
CCOC(=O)C(=CC1=CC(=C(C=C1)OCCOC2=CC=C(C=C2)C(C)(C)C)OC)C#N
CCOC(=O)C(=Cc1ccc(c(c1)OC)OCCOc1ccc(cc1)C(C)(C)C)C#N
ETHYL(2E)3(4(2(4TERTBUTYLPHENOXY)ETHOXY)3METHOXYPHENYL)2CYANOPROP2ENOATE
ETHYL(E)3(4(2(4TERTBUTYLPHENOXY)ETHOXY)3METHOXYPHENYL)2CYANOPROP2ENOATE
InChI=1SC25H29NO5c162924(27)19(1726)151871222(23(1618)285)311413302110820(91121)25(23)4h7121516H61314H215H3b1915+
MFCD08672996
ZINC000004694958
ZINC04694958
ZINC4694958
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