Vitas-M small molecule compound
(4Z)-2-(4-tert-butylphenyl)-4-[2-(heptyloxy)benzylidene]-1,3-oxazol-5(4H)-one
Catalog ID
STL416824
SMILES CCCCCCCOc1ccccc1/C=C/1\N=C(OC1=O)c1ccc(cc1)C(C)(C)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 C27H33NO3 MW 419.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO3/c1-5-6-7-8-11-18-30-24-13-10-9-12-21(24)19-23-26(29)31-25(28-23)20-14-16-22(17-15-20)27(2,3)4/h9-10,12-17,19H,5-8,11,18H2,1-4H3/b23-19-InChIKey
KSYJBSRTUKCZMC-NMWGTECJSA-NSynonyms
(4Z)2(4TERTBUTYLPHENYL)4((2HEPTOXYPHENYL)METHYLIDENE)13OXAZOL5ONE
(4Z)2(4tertbutylphenyl)4(2(heptyloxy)benzylidene)13oxazol5(4H)one
2(4(TERTBUTYL)PHENYL)4((2HEPTYLOXYPHENYL)METHYLENE)13OXAZOLIN5ONE
2(4TERTBUTYLPHENYL)4(2HEPTYLOXYBENZYLIDENE)4HOXAZOL5ONE
CCCCCCCOC1=CC=CC=C1C=C2C(=O)OC(=N2)C3=CC=C(C=C3)C(C)(C)C
CCCCCCCOc1ccccc1C=C1N=C(OC1=O)c1ccc(cc1)C(C)(C)C
InChI=1SC27H33NO3c1567811183024131091221(24)192326(29)3125(2823)20141622(171520)27(23)4h910121719H581118H214H3b2319
MFCD00501298
ZINC000003016903
ZINC3016903
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