Vitas-M small molecule compound
(2E)-3-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-ethoxyphenyl)-2-phenylprop-2-enenitrile
Catalog ID
STK001769
SMILES CCOc1cc(ccc1OCCOc1ccc(cc1)C(CC)C)/C=C(\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 C29H31NO3 MW 441.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31NO3/c1-4-22(3)24-12-14-27(15-13-24)32-17-18-33-28-16-11-23(20-29(28)31-5-2)19-26(21-30)25-9-7-6-8-10-25/h6-16,19-20,22H,4-5,17-18H2,1-3H3/b26-19-InChIKey
UXJRHKCIYGRLBZ-XHPQRKPJSA-NSynonyms
(2E)3(3ETHOXY4(2(4(METHYLPROPYL)PHENOXY)ETHOXY)PHENYL)2PHENYLPROP2ENENITRILE
(2E)3(4(2(4(BUTAN2YL)PHENOXY)ETHOXY)3ETHOXYPHENYL)2PHENYLPROP2ENENITRILE
(E)3(4(2(4butan2ylphenoxy)ethoxy)3ethoxyphenyl)2phenylprop2enenitrile
CCC(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=C(C#N)C3=CC=CC=C3)OCC
CCOc1cc(ccc1OCCOc1ccc(cc1)C(CC)C)C=C(c1ccccc1)C#N
InChI=1SC29H31NO3c1422(3)24121427(151324)3217183328161123(2029(28)3152)1926(2130)2597681025h616192022H451718H213H3b2619
MFCD01873998
STK001769
ZINC000004196625
ZINC000004196626
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