Vitas-M small molecule compound
(2E)-1-(4-bromophenyl)-3-[(3,4-dimethoxyphenyl)amino]prop-2-en-1-one
Catalog ID
STK056702
SMILES COc1cc(N/C=C/C(=O)c2ccc(cc2)Br)ccc1OC
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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 C17H16BrNO3 MW 362.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrNO3/c1-21-16-8-7-14(11-17(16)22-2)19-10-9-15(20)12-3-5-13(18)6-4-12/h3-11,19H,1-2H3/b10-9+InChIKey
DTBUGEQIDMRDPR-MDZDMXLPSA-NSynonyms
(2E)1(4BROMOPHENYL)3((34DIMETHOXYPHENYL)AMINO)PROP2EN1ONE
(E)1(4BROMOPHENYL)3(34DIMETHOXYANILINO)PROP2EN1ONE
COC1=C(C=C(C=C1)NC=CC(=O)C2=CC=C(C=C2)Br)OC
COc1cc(NC=CC(=O)c2ccc(cc2)Br)ccc1OC
InChI=1SC17H16BrNO3c121168714(1117(16)222)1910915(20)123513(18)6412h31119H12H3b109+
MFCD08051355
STK056702
ZINC000005578880
ZINC05578880
ZINC5578880
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