Vitas-M small molecule compound
(4E)-4-(3-chloro-5-ethoxy-4-propoxybenzylidene)-2-(3-methylphenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STL170871
SMILES CCCOc1c(Cl)cc(cc1OCC)/C=C\1/N=C(OC1=O)c1cccc(c1)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 C22H22ClNO4 MW 399.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClNO4/c1-4-9-27-20-17(23)11-15(13-19(20)26-5-2)12-18-22(25)28-21(24-18)16-8-6-7-14(3)10-16/h6-8,10-13H,4-5,9H2,1-3H3/b18-12+InChIKey
LRAPVMVSFICZDY-LDADJPATSA-NSynonyms
332017-83-1(4E)4((3CHLORO5ETHOXY4PROPOXYPHENYL)METHYLIDENE)2(3METHYLPHENYL)13OXAZOL5ONE
(4E)4(3chloro5ethoxy4propoxybenzylidene)2(3methylphenyl)13oxazol5(4H)one
332017831
4(3CHLORO5ETHOXY4PROPOXYBENZYLIDENE)2(3METHYLPHENYL)13OXAZOL5(4H)ONE
CCCOC1=C(C=C(C=C1Cl)C=C2C(=O)OC(=N2)C3=CC(=CC=C3)C)OCC
CCCOc1c(Cl)cc(cc1OCC)C=C1N=C(OC1=O)c1cccc(c1)C
InChI=1SC22H22ClNO4c149272017(23)1115(1319(20)2652)121822(25)2821(2418)1686714(3)1016h681013H459H213H3b1812+
MFCD01417327
ZINC000002081275
ZINC02081275
ZINC2081275
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