Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one
Catalog ID
STK897192
SMILES CCCCOc1ccc(cc1)C(=O)/C(=C/c1ccc(cc1)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 C27H25NO3 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO3/c1-3-4-17-30-22-15-13-21(14-16-22)26(29)23(18-20-11-9-19(2)10-12-20)27-28-24-7-5-6-8-25(24)31-27/h5-16,18H,3-4,17H2,1-2H3/b23-18-InChIKey
MRLDBXPDGBAPEB-NKFKGCMQSA-NSynonyms
488851-44-1(2E)2(13benzoxazol2yl)1(4butoxyphenyl)3(4methylphenyl)prop2en1one
(2E)2BENZOXAZOL2YL1(4BUTOXYPHENYL)3(4METHYLPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)1(4BUTOXYPHENYL)3(4METHYLPHENYL)PROP2EN1ONE
(E)2(benzo(d)oxazol2yl)1(4butoxyphenyl)3(ptolyl)prop2en1one
488851441
CCCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC=C(C=C2)C)C3=NC4=CC=CC=C4O3
CCCCOc1ccc(cc1)C(=O)C(=Cc1ccc(cc1)C)c1nc2c(o1)cccc2
InChI=1SC27H25NO3c134173022151321(141622)26(29)23(182011919(2)101220)272824756825(24)3127h51618H3417H212H3b2318
MFCD03294623
ZINC000004889213
ZINC04889213
ZINC4889213
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