Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-3-(3-bromophenyl)-1-(4-butoxyphenyl)prop-2-en-1-one
Catalog ID
STK897397
SMILES CCCCOc1ccc(cc1)C(=O)/C(=C/c1cccc(c1)Br)/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 C26H22BrNO3 MW 476.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22BrNO3/c1-2-3-15-30-21-13-11-19(12-14-21)25(29)22(17-18-7-6-8-20(27)16-18)26-28-23-9-4-5-10-24(23)31-26/h4-14,16-17H,2-3,15H2,1H3/b22-17-InChIKey
LTHNOMWADUQFTM-XLNRJJMWSA-NSynonyms
(2E)2(13benzoxazol2yl)3(3bromophenyl)1(4butoxyphenyl)prop2en1one
(2E)2BENZOXAZOL2YL3(3BROMOPHENYL)1(4BUTOXYPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)3(3BROMOPHENYL)1(4BUTOXYPHENYL)PROP2EN1ONE
CCCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC(=CC=C2)Br)C3=NC4=CC=CC=C4O3
CCCCOc1ccc(cc1)C(=O)C(=Cc1cccc(c1)Br)c1nc2c(o1)cccc2
InChI=1SC26H22BrNO3c123153021131119(121421)25(29)22(171876820(27)1618)2628239451024(23)3126h4141617H2315H21H3b2217
MFCD03650935
ZINC000009030805
ZINC09030805
ZINC9030805
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