Vitas-M small molecule compound
5-amino-3-{(Z)-2-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]-1-cyanoethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
Catalog ID
STK760370
SMILES N#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 C22H15BrN6O2 MW 475.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15BrN6O2/c1-30-19-11-14(10-18(23)21(19)31-8-7-24)9-15(12-25)20-17(13-26)22(27)29(28-20)16-5-3-2-4-6-16/h2-6,9-11H,8,27H2,1H3/b15-9+InChIKey
DZHYVGPHUIUGSJ-OQLLNIDSSA-NSynonyms
5amino3((Z)2(3bromo4(cyanomethoxy)5methoxyphenyl)1cyanoethenyl)1phenyl1Hpyrazole4carbonitrile
5AMINO3((Z)2(3BROMO4(CYANOMETHOXY)5METHOXYPHENYL)1CYANOETHENYL)1PHENYLPYRAZOLE4CARBONITRILE
COC1=C(C(=CC(=C1)C=C(C#N)C2=NN(C(=C2C#N)N)C3=CC=CC=C3)Br)OCC#N
InChI=1SC22H15BrN6O2c130191114(1018(23)21(19)318724)915(1225)2017(1326)22(27)29(2820)165324616h26911H827H21H3b159+
MFCD01066150
N#CCOc1c(Br)cc(cc1OC)C=C(c1nn(c(c1C#N)N)c1ccccc1)C#N
ZINC000012418859
ZINC12418859
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