Vitas-M small molecule compound
2-bromo-4-{(E)-[2-(4-tert-butylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-6-methoxyphenyl acetate
Catalog ID
STK957391
SMILES COc1cc(/C=C\2/N=C(OC2=O)c2ccc(cc2)C(C)(C)C)cc(c1OC(=O)C)Br
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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 C23H22BrNO5 MW 472.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrNO5/c1-13(26)29-20-17(24)10-14(12-19(20)28-5)11-18-22(27)30-21(25-18)15-6-8-16(9-7-15)23(2,3)4/h6-12H,1-5H3/b18-11+InChIKey
UKGGGZAPPSHGFL-WOJGMQOQSA-NSynonyms
354997-15-2(2BROMO4((E)(2(4TERTBUTYLPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)6METHOXYPHENYL)ACETATE
2BROMO4((2(4TERTBUTYLPHENYL)5OXO13OXAZOL4(5H)YLIDENE)METHYL)6METHOXYPHENYLACETATE
2bromo4((E)(2(4tertbutylphenyl)5oxo13oxazol4(5H)ylidene)methyl)6methoxyphenylacetate
354997152
CC(=O)OC1=C(C=C(C=C1Br)C=C2C(=O)OC(=N2)C3=CC=C(C=C3)C(C)(C)C)OC
COc1cc(C=C2N=C(OC2=O)c2ccc(cc2)C(C)(C)C)cc(c1OC(=O)C)Br
InChI=1SC23H22BrNO5c113(26)292017(24)1014(1219(20)285)111822(27)3021(2518)156816(9715)23(23)4h612H15H3b1811+
MFCD01834412
ZINC000002082878
ZINC02082878
ZINC2082878
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