Vitas-M small molecule compound
(2Z)-2-cyano-N-cyclohexyl-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STK822933
SMILES CCOc1ccc(cc1C)c1nn(cc1/C=C(\C(=O)NC1CCCCC1)/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 C28H30N4O2 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O2/c1-3-34-26-15-14-21(16-20(26)2)27-23(19-32(31-27)25-12-8-5-9-13-25)17-22(18-29)28(33)30-24-10-6-4-7-11-24/h5,8-9,12-17,19,24H,3-4,6-7,10-11H2,1-2H3,(H,30,33)/b22-17-InChIKey
JPAYEIPAJGCJLE-XLNRJJMWSA-NSynonyms
(2Z)2cyanoNcyclohexyl3(3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)prop2enamide
(Z)2cyanoNcyclohexyl3(3(4ethoxy3methylphenyl)1phenylpyrazol4yl)prop2enamide
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3CCCCC3)C4=CC=CC=C4)C
CCOc1ccc(cc1C)c1nn(cc1C=C(C(=O)NC1CCCCC1)C#N)c1ccccc1
InChI=1SC28H30N4O2c133426151421(1620(26)2)2723(1932(3127)25128591325)1722(1829)28(33)3024106471124h58912171924H34671011H212H3(H3033)b2217
MFCD03463494
ZINC000027017941
ZINC27017941
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