Vitas-M small molecule compound
(2E)-3-(3-{4-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK810546
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)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 C31H27ClN4O3 MW 539.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27ClN4O3/c32-29-11-5-4-7-23(29)21-39-27-14-12-22(13-15-27)30-25(20-36(35-30)26-8-2-1-3-9-26)17-24(18-33)31(37)34-19-28-10-6-16-38-28/h1-5,7-9,11-15,17,20,28H,6,10,16,19,21H2,(H,34,37)/b24-17+InChIKey
WSQZTPDEAWEBJA-JJIBRWJFSA-NSynonyms
(2E)3(3(4((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2cyanoN(tetrahydrofuran2ylmethyl)prop2enamide
(2E)3(3(4((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYL1HPYRAZOL4YL)2CYANON(OXOLAN2YLMETHYL)PROP2ENAMIDE
(E)3(3(4((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)2CYANON(OXOLAN2YLMETHYL)PROP2ENAMIDE
C1CC(OC1)CNC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C5=CC=CC=C5)C#N
InChI=1SC31H27ClN4O3c32291154723(29)213927141222(131527)3025(2036(3530)268213926)1724(1833)31(37)341928106163828h15791115172028H610161921H2(H3437)b2417+
MFCD04554870
ZINC000097946317
ZINC000097946318
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