Vitas-M small molecule compound
(2Z)-3-[3-(3-chloro-4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK897347
SMILES CCOc1ccc(cc1Cl)c1nn(cc1/C=C(\C(=O)NCC1CCCO1)/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 C26H25ClN4O3 MW 476.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O3/c1-2-33-24-11-10-18(14-23(24)27)25-20(17-31(30-25)21-7-4-3-5-8-21)13-19(15-28)26(32)29-16-22-9-6-12-34-22/h3-5,7-8,10-11,13-14,17,22H,2,6,9,12,16H2,1H3,(H,29,32)/b19-13-InChIKey
SQSDSMOXINJCJW-UYRXBGFRSA-NSynonyms
(2Z)3(3(3chloro4ethoxyphenyl)1phenyl1Hpyrazol4yl)2cyanoN(tetrahydrofuran2ylmethyl)prop2enamide
(2Z)3(3(3CHLORO4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)2CYANON(OXOLAN2YLMETHYL)PROP2ENAMIDE
(Z)3(3(3CHLORO4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)2CYANON(OXOLAN2YLMETHYL)PROP2ENAMIDE
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3CCCO3)C4=CC=CC=C4)Cl
CCOc1ccc(cc1Cl)c1nn(cc1C=C(C(=O)NCC1CCCO1)C#N)c1ccccc1
InChI=1SC26H25ClN4O3c123324111018(1423(24)27)2520(1731(3025)217435821)1319(1528)26(32)29162296123422h3578101113141722H2691216H21H3(H2932)b1913
MFCD03650916
ZINC000016712645
ZINC000016712647
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