Vitas-M small molecule compound
(4E)-4-{3,4-bis[(2-methylbenzyl)oxy]benzylidene}-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
Catalog ID
STL172730
SMILES O=C1OC(=N/C/1=C/c1ccc(c(c1)OCc1ccccc1C)OCc1ccccc1C)c1cccc2c1cccc2
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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 C36H29NO4 MW 539.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29NO4/c1-24-10-3-5-13-28(24)22-39-33-19-18-26(21-34(33)40-23-29-14-6-4-11-25(29)2)20-32-36(38)41-35(37-32)31-17-9-15-27-12-7-8-16-30(27)31/h3-21H,22-23H2,1-2H3/b32-20+InChIKey
UNSPUIBMAJFLHQ-UZWMFBFFSA-NSynonyms
581781-68-2(4E)4((34BIS((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)2NAPHTHALEN1YL13OXAZOL5ONE
(4E)4(34bis((2methylbenzyl)oxy)benzylidene)2(naphthalen1yl)13oxazol5(4H)one
581781682
CC1=CC=CC=C1COC2=C(C=C(C=C2)C=C3C(=O)OC(=N3)C4=CC=CC5=CC=CC=C54)OCC6=CC=CC=C6C
InChI=1SC36H29NO4c12410351328(24)223933191826(2134(33)40232914641125(29)2)203236(38)4135(3732)31179152712781630(27)31h321H2223H212H3b3220+
MFCD01446953
O=C1OC(=NC1=Cc1ccc(c(c1)OCc1ccccc1C)OCc1ccccc1C)c1cccc2c1cccc2
ZINC000002737852
ZINC2737852
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