Vitas-M small molecule compound
(2E)-2-cyano-N-cyclohexyl-3-(3-{4-[(4-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)prop-2-enamide
Catalog ID
STK823881
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccc(cc1)F)c1ccccc1)/C(=O)NC1CCCCC1
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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 C32H29FN4O2 MW 520.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29FN4O2/c33-27-15-11-23(12-16-27)22-39-30-17-13-24(14-18-30)31-26(21-37(36-31)29-9-5-2-6-10-29)19-25(20-34)32(38)35-28-7-3-1-4-8-28/h2,5-6,9-19,21,28H,1,3-4,7-8,22H2,(H,35,38)/b25-19+InChIKey
UNSYMKUMHWHVBO-NCELDCMTSA-NSynonyms
(2E)2cyanoNcyclohexyl3(3(4((4fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)prop2enamide
(E)2CYANONCYCLOHEXYL3(3(4((4FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)PROP2ENAMIDE
C1CCC(CC1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=C(C=C4)F)C5=CC=CC=C5)C#N
InChI=1SC32H29FN4O2c3327151123(121627)223930171324(141830)3126(2137(3631)2995261029)1925(2034)32(38)35287314828h2569192128H1347822H2(H3538)b2519+
MFCD18075751
N#CC(=Cc1cn(nc1c1ccc(cc1)OCc1ccc(cc1)F)c1ccccc1)C(=O)NC1CCCCC1
ZINC000027021232
ZINC27021232
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