Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-1-(3-methoxyphenyl)-3-(2-methyl-2H-chromen-3-yl)prop-2-en-1-one
Catalog ID
STL010914
SMILES COc1cccc(c1)C(=O)/C(=C/C1=Cc2ccccc2OC1C)/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 C27H21NO4 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21NO4/c1-17-20(14-18-8-3-5-12-24(18)31-17)16-22(26(29)19-9-7-10-21(15-19)30-2)27-28-23-11-4-6-13-25(23)32-27/h3-17H,1-2H3/b22-16-InChIKey
NISSZKNMXZFBSD-JWGURIENSA-NSynonyms
929962-40-3(2E)2(13benzoxazol2yl)1(3methoxyphenyl)3(2methyl2Hchromen3yl)prop2en1one
(E)2(13benzoxazol2yl)1(3methoxyphenyl)3(2methyl2Hchromen3yl)prop2en1one
(E)2(benzo(d)oxazol2yl)1(3methoxyphenyl)3(2methyl2Hchromen3yl)prop2en1one
929962403
CC1C(=CC2=CC=CC=C2O1)C=C(C3=NC4=CC=CC=C4O3)C(=O)C5=CC(=CC=C5)OC
COc1cccc(c1)C(=O)C(=CC1=Cc2ccccc2OC1C)c1nc2c(o1)cccc2
InChI=1SC27H21NO4c11720(14188351224(18)3117)1622(26(29)19971021(1519)302)27282311461325(23)3227h317H12H3b2216
MFCD09849426
ZINC000009054224
ZINC000013681755
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