Vitas-M small molecule compound
(2Z)-3-[3-(4-butoxy-3-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Catalog ID
STK706842
SMILES CCCCOc1ccc(cc1Cl)c1nn(cc1/C=C(\c1nc2c(n1C)cccc2)/C#N)c1ccccc1
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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 C30H26ClN5O MW 508.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN5O/c1-3-4-16-37-28-15-14-21(18-25(28)31)29-23(20-36(34-29)24-10-6-5-7-11-24)17-22(19-32)30-33-26-12-8-9-13-27(26)35(30)2/h5-15,17-18,20H,3-4,16H2,1-2H3/b22-17-InChIKey
ZHETZSHMTJIUIB-XLNRJJMWSA-NSynonyms
1008882-05-0(2Z)3(3(4butoxy3chlorophenyl)1phenyl1Hpyrazol4yl)2(1methyl1Hbenzimidazol2yl)prop2enenitrile
(Z)3(3(4butoxy3chlorophenyl)1phenyl1Hpyrazol4yl)2(1methyl1Hbenzo(d)imidazol2yl)acrylonitrile
(Z)3(3(4butoxy3chlorophenyl)1phenylpyrazol4yl)2(1methylbenzimidazol2yl)prop2enenitrile
1008882050
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C3=NC4=CC=CC=C4N3C)C5=CC=CC=C5)Cl
CCCCOc1ccc(cc1Cl)c1nn(cc1C=C(c1nc2c(n1C)cccc2)C#N)c1ccccc1
InChI=1SC30H26ClN5Oc134163728151421(1825(28)31)2923(2036(3429)24106571124)1722(1932)30332612891327(26)35(30)2h515171820H3416H212H3b2217
MFCD04009229
ZINC000009464926
ZINC09464926
ZINC9464926
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