Vitas-M small molecule compound
(2Z)-2-(1H-benzimidazol-2-yl)-3-[3-(3-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Catalog ID
STK706870
SMILES CCOc1cccc(c1)c1nn(cc1/C=C(\c1nc2c([nH]1)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 C27H21N5O MW 431.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N5O/c1-2-33-23-12-8-9-19(16-23)26-21(18-32(31-26)22-10-4-3-5-11-22)15-20(17-28)27-29-24-13-6-7-14-25(24)30-27/h3-16,18H,2H2,1H3,(H,29,30)/b20-15-InChIKey
UNHUWKFYSVNWGA-HKWRFOASSA-NSynonyms
1008884-16-9(2Z)2(1Hbenzimidazol2yl)3(3(3ethoxyphenyl)1phenyl1Hpyrazol4yl)prop2enenitrile
(Z)2(1Hbenzimidazol2yl)3(3(3ethoxyphenyl)1phenylpyrazol4yl)prop2enenitrile
(Z)2(1Hbenzo(d)imidazol2yl)3(3(3ethoxyphenyl)1phenyl1Hpyrazol4yl)acrylonitrile
1008884169
CCOC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C3=NC4=CC=CC=C4N3)C5=CC=CC=C5
CCOc1cccc(c1)c1nn(cc1C=C(c1nc2c((nH)1)cccc2)C#N)c1ccccc1
InChI=1SC27H21N5Oc123323128919(1623)2621(1832(3126)22104351122)1520(1728)27292413671425(24)3027h31618H2H21H3(H2930)b2015
MFCD04024720
ZINC000009424577
ZINC09424577
ZINC9424577
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