Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-3-[4-(prop-2-en-1-yloxy)phenyl]-1-(4-propoxyphenyl)prop-2-en-1-one
Catalog ID
STK982813
SMILES CCCOc1ccc(cc1)C(=O)/C(=C/c1ccc(cc1)OCC=C)/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 C28H25NO4 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25NO4/c1-3-17-31-22-13-9-20(10-14-22)19-24(28-29-25-7-5-6-8-26(25)33-28)27(30)21-11-15-23(16-12-21)32-18-4-2/h3,5-16,19H,1,4,17-18H2,2H3/b24-19-InChIKey
VLUPEUDLWZGSSO-CLCOLTQESA-NSynonyms
(2E)2(13benzoxazol2yl)3(4(prop2en1yloxy)phenyl)1(4propoxyphenyl)prop2en1one
(2E)2BENZOXAZOL2YL3(4PROP2ENYLOXYPHENYL)1(4PROPOXYPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)3(4PROP2ENOXYPHENYL)1(4PROPOXYPHENYL)PROP2EN1ONE
CCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC=C(C=C2)OCC=C)C3=NC4=CC=CC=C4O3
CCCOc1ccc(cc1)C(=O)C(=Cc1ccc(cc1)OCC=C)c1nc2c(o1)cccc2
InChI=1SC28H25NO4c1317312213920(101422)1924(282925756826(25)3328)27(30)21111523(161221)321842h351619H141718H22H3b2419
MFCD03497074
ZINC000008779097
ZINC08779097
ZINC8779097
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