Vitas-M small molecule compound
(2E)-1-(4-bromo-1-ethyl-1H-pyrazol-5-yl)-3-(4-ethoxyphenyl)prop-2-en-1-one
Catalog ID
STL403363
SMILES CCOc1ccc(cc1)/C=C/C(=O)c1c(Br)cnn1CC
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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 C16H17BrN2O2 MW 349.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrN2O2/c1-3-19-16(14(17)11-18-19)15(20)10-7-12-5-8-13(9-6-12)21-4-2/h5-11H,3-4H2,1-2H3/b10-7+InChIKey
WDCXAZRVJQYLMC-JXMROGBWSA-NSynonyms
1005557-67-4(2E)1(4bromo1ethyl1Hpyrazol5yl)3(4ethoxyphenyl)prop2en1one
(E)1(4BROMO2ETHYLPYRAZOL3YL)3(4ETHOXYPHENYL)PROP2EN1ONE
1005557674
CCN1C(=C(C=N1)Br)C(=O)C=CC2=CC=C(C=C2)OCC
CCOc1ccc(cc1)C=CC(=O)c1c(Br)cnn1CC
InChI=1SC16H17BrN2O2c131916(14(17)111819)15(20)107125813(9612)2142h511H34H212H3b107+
MFCD04133289
ZINC000006556024
ZINC06556024
ZINC6556024
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