Vitas-M small molecule compound
(2Z)-3-[3-(3-chloro-4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N-[3-(1H-imidazol-1-yl)propyl]prop-2-enamide
Catalog ID
STK706843
SMILES CCOc1ccc(cc1Cl)c1nn(cc1/C=C(\C(=O)NCCCn1cncc1)/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 C27H25ClN6O2 MW 500.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN6O2/c1-2-36-25-10-9-20(16-24(25)28)26-22(18-34(32-26)23-7-4-3-5-8-23)15-21(17-29)27(35)31-11-6-13-33-14-12-30-19-33/h3-5,7-10,12,14-16,18-19H,2,6,11,13H2,1H3,(H,31,35)/b21-15-InChIKey
QOHNGIHVLBFZIP-QNGOZBTKSA-NSynonyms
(2Z)3(3(3chloro4ethoxyphenyl)1phenyl1Hpyrazol4yl)2cyanoN(3(1Himidazol1yl)propyl)prop2enamide
(E)N(3(1Himidazol1yl)propyl)3(3(3chloro4ethoxyphenyl)1phenyl1Hpyrazol4yl)2cyanoacrylamide
(Z)3(3(3chloro4ethoxyphenyl)1phenylpyrazol4yl)2cyanoN(3imidazol1ylpropyl)prop2enamide
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCCN3C=CN=C3)C4=CC=CC=C4)Cl
CCOc1ccc(cc1Cl)c1nn(cc1C=C(C(=O)NCCCn1cncc1)C#N)c1ccccc1
InChI=1SC27H25ClN6O2c12362510920(1624(25)28)2622(1834(3226)237435823)1521(1729)27(35)3111613331412301933h357101214161819H261113H21H3(H3135)b2115
MFCD13371153
ZINC000026779629
ZINC26779629
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