Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-3-(4-chlorophenyl)-1-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK793988
SMILES COc1cc(cc(c1OC)OC)C(=O)/C(=C/c1ccc(cc1)Cl)/c1nc2c(o1)cccc2
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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 C25H20ClNO5 MW 449.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClNO5/c1-29-21-13-16(14-22(30-2)24(21)31-3)23(28)18(12-15-8-10-17(26)11-9-15)25-27-19-6-4-5-7-20(19)32-25/h4-14H,1-3H3/b18-12-InChIKey
BNCCOTVXLZZPAN-PDGQHHTCSA-NSynonyms
(2E)2(13benzoxazol2yl)3(4chlorophenyl)1(345trimethoxyphenyl)prop2en1one
(2E)2BENZOXAZOL2YL3(4CHLOROPHENYL)1(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)3(4CHLOROPHENYL)1(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)2(benzo(d)oxazol2yl)3(4chlorophenyl)1(345trimethoxyphenyl)prop2en1one
2(13BENZOXAZOL2YL)3(4CHLOROPHENYL)1(345TRIMETHOXYPHENYL)2PROPEN1ONE
COC1=CC(=CC(=C1OC)OC)C(=O)C(=CC2=CC=C(C=C2)Cl)C3=NC4=CC=CC=C4O3
COc1cc(cc(c1OC)OC)C(=O)C(=Cc1ccc(cc1)Cl)c1nc2c(o1)cccc2
InChI=1SC25H20ClNO5c129211316(1422(302)24(21)313)23(28)18(121581017(26)11915)252719645720(19)3225h414H13H3b1812
MFCD03498503
ZINC000008437026
ZINC08437026
ZINC8437026
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