Vitas-M small molecule compound
4-{(E)-[2-(3-chloro-4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-methoxyphenyl benzoate
Catalog ID
STL420527
SMILES COc1cc(ccc1OC(=O)c1ccccc1)/C=C\1/N=C(OC1=O)c1ccc(c(c1)Cl)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 C25H18ClNO5 MW 447.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClNO5/c1-15-8-10-18(14-19(15)26)23-27-20(25(29)32-23)12-16-9-11-21(22(13-16)30-2)31-24(28)17-6-4-3-5-7-17/h3-14H,1-2H3/b20-12+InChIKey
IJLJXPRTIZQEKH-UDWIEESQSA-NSynonyms
(4((E)(2(3CHLORO4METHYLPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)2METHOXYPHENYL)BENZOATE
4((E)(2(3chloro4methylphenyl)5oxo13oxazol4(5H)ylidene)methyl)2methoxyphenylbenzoate
CC1=C(C=C(C=C1)C2=NC(=CC3=CC(=C(C=C3)OC(=O)C4=CC=CC=C4)OC)C(=O)O2)Cl
COc1cc(ccc1OC(=O)c1ccccc1)C=C1N=C(OC1=O)c1ccc(c(c1)Cl)C
InChI=1SC25H18ClNO5c11581018(1419(15)26)232720(25(29)3223)121691121(22(1316)302)3124(28)176435717h314H12H3b2012+
MFCD06668780
ZINC000015229316
ZINC15229316
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