Vitas-M small molecule compound
5-amino-3-[(Z)-2-(3-bromo-4-ethoxy-5-methoxyphenyl)-1-cyanoethenyl]-1-phenyl-1H-pyrazole-4-carbonitrile
Catalog ID
STK828433
SMILES CCOc1c(Br)cc(cc1OC)/C=C(/c1nn(c(c1C#N)N)c1ccccc1)\C#N
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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 C22H18BrN5O2 MW 464.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN5O2/c1-3-30-21-18(23)10-14(11-19(21)29-2)9-15(12-24)20-17(13-25)22(26)28(27-20)16-7-5-4-6-8-16/h4-11H,3,26H2,1-2H3/b15-9+InChIKey
WLSGTHWXPOYQBC-OQLLNIDSSA-NSynonyms
3((1Z)2(3BROMO4ETHOXY5METHOXYPHENYL)1CYANOVINYL)5AMINO1PHENYLPYRAZOLE4CARBONITRILE
5amino3((Z)2(3bromo4ethoxy5methoxyphenyl)1cyanoethenyl)1phenyl1Hpyrazole4carbonitrile
5AMINO3((Z)2(3BROMO4ETHOXY5METHOXYPHENYL)1CYANOETHENYL)1PHENYLPYRAZOLE4CARBONITRILE
CCOC1=C(C=C(C=C1Br)C=C(C#N)C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OC
CCOc1c(Br)cc(cc1OC)C=C(c1nn(c(c1C#N)N)c1ccccc1)C#N
InChI=1SC22H18BrN5O2c13302118(23)1014(1119(21)292)915(1224)2017(1325)22(26)28(2720)167546816h411H326H212H3b159+
MFCD01036054
ZINC000013590123
ZINC13590123
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