Vitas-M small molecule compound

(4E)-3-(4-methylphenyl)-4-[4-(pentyloxy)benzylidene]-1,2-oxazol-5(4H)-one

Catalog ID
STK074219
SMILES CCCCCOc1ccc(cc1)/C=C\1/C(=O)ON=C1c1ccc(cc1)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 C22H23NO3 MW 349.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO3/c1-3-4-5-14-25-19-12-8-17(9-13-19)15-20-21(23-26-22(20)24)18-10-6-16(2)7-11-18/h6-13,15H,3-5,14H2,1-2H3/b20-15+
InChIKey
PRTQRJRJTYPAFD-HMMYKYKNSA-N
Synonyms

(4E)3(4METHYLPHENYL)4((4PENTOXYPHENYL)METHYLIDENE)12OXAZOL5ONE
(4E)3(4METHYLPHENYL)4(4(PENTYLOXY)BENZYLIDENE)12OXAZOL5(4H)ONE
(Z)4(4(pentyloxy)benzylidene)3(ptolyl)isoxazol5(4H)one
CCCCCOC1=CC=C(C=C1)C=C2C(=NOC2=O)C3=CC=C(C=C3)C
CCCCCOc1ccc(cc1)C=C1C(=O)ON=C1c1ccc(cc1)C
InChI=1SC22H23NO3c134514251912817(91319)152021(232622(20)24)1810616(2)71118h61315H3514H212H3b2015+
MFCD01895847
STK074219
ZINC000002290620
ZINC02290620
ZINC2290620

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Available files

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