Vitas-M small molecule compound
5-amino-3-{(Z)-1-cyano-2-[3,5-dibromo-2-(prop-2-en-1-yloxy)phenyl]ethenyl}-1H-pyrazole-4-carbonitrile
Catalog ID
STK676207
SMILES C=CCOc1c(Br)cc(cc1/C=C(/c1n[nH]c(c1C#N)N)\C#N)Br
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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 C16H11Br2N5O MW 449.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11Br2N5O/c1-2-3-24-15-9(5-11(17)6-13(15)18)4-10(7-19)14-12(8-20)16(21)23-22-14/h2,4-6H,1,3H2,(H3,21,22,23)/b10-4+InChIKey
RBZPMPAYRJFRNO-ONNFQVAWSA-NSynonyms
3AMINO5((Z)1CYANO2(35DIBROMO2PROP2ENOXYPHENYL)ETHENYL)1HPYRAZOLE4CARBONITRILE
5amino3((Z)1cyano2(35dibromo2(prop2en1yloxy)phenyl)ethenyl)1Hpyrazole4carbonitrile
C=CCOC1=C(C=C(C=C1C=C(C#N)C2=C(C(=NN2)N)C#N)Br)Br
C=CCOc1c(Br)cc(cc1C=C(c1n(nH)c(c1C#N)N)C#N)Br
InChI=1SC16H11Br2N5Oc12324159(511(17)613(15)18)410(719)1412(820)16(21)232214h246H13H2(H3212223)b104+
MFCD01363596
ZINC000009010476
ZINC09010476
ZINC9010476
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