Vitas-M small molecule compound
(2Z)-2-cyano-N-(furan-2-ylmethyl)-3-{3-[4-(3-methylbutoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enamide
Catalog ID
STK702927
SMILES N#C/C(=C/c1cn(nc1c1ccc(cc1)OCCC(C)C)c1ccccc1)/C(=O)NCc1ccco1
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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 C29H28N4O3 MW 480.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O3/c1-21(2)14-16-36-26-12-10-22(11-13-26)28-24(20-33(32-28)25-7-4-3-5-8-25)17-23(18-30)29(34)31-19-27-9-6-15-35-27/h3-13,15,17,20-21H,14,16,19H2,1-2H3,(H,31,34)/b23-17-InChIKey
CBTWRBAKURZBLG-QJOMJCCJSA-NSynonyms
(2Z)2cyanoN(furan2ylmethyl)3(3(4(3methylbutoxy)phenyl)1phenyl1Hpyrazol4yl)prop2enamide
(E)2cyanoN(furan2ylmethyl)3(3(4(isopentyloxy)phenyl)1phenyl1Hpyrazol4yl)acrylamide
(Z)2CYANON(FURAN2YLMETHYL)3(3(4(3METHYLBUTOXY)PHENYL)1PHENYLPYRAZOL4YL)PROP2ENAMIDE
CC(C)CCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CC=CO3)C4=CC=CC=C4
InChI=1SC29H28N4O3c121(2)14163626121022(111326)2824(2033(3228)257435825)1723(1830)29(34)31192796153527h31315172021H141619H212H3(H3134)b2317
MFCD03461764
N#CC(=Cc1cn(nc1c1ccc(cc1)OCCC(C)C)c1ccccc1)C(=O)NCc1ccco1
ZINC000001241660
ZINC01241660
ZINC1241660
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