Vitas-M small molecule compound
ethyl (2E)-2-cyano-3-{1-phenyl-3-[3-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}prop-2-enoate
Catalog ID
STK904404
SMILES CCOC(=O)/C(=C/c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCCC1)c1ccccc1)/C#N
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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 C26H26N4O4S MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O4S/c1-2-34-26(31)21(18-27)16-22-19-30(23-11-5-3-6-12-23)28-25(22)20-10-9-13-24(17-20)35(32,33)29-14-7-4-8-15-29/h3,5-6,9-13,16-17,19H,2,4,7-8,14-15H2,1H3/b21-16+InChIKey
JGFZHOOLIIILOG-LTGZKZEYSA-NSynonyms
(Z)ethyl2cyano3(1phenyl3(3(piperidin1ylsulfonyl)phenyl)1Hpyrazol4yl)acrylate
CCOC(=O)C(=CC1=CN(N=C1C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C4=CC=CC=C4)C#N
CCOC(=O)C(=Cc1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCCC1)c1ccccc1)C#N
ethyl(2E)2cyano3(1phenyl3(3(piperidin1ylsulfonyl)phenyl)1Hpyrazol4yl)prop2enoate
ETHYL(E)2CYANO3(1PHENYL3(3PIPERIDIN1YLSULFONYLPHENYL)PYRAZOL4YL)PROP2ENOATE
InChI=1SC26H26N4O4Sc123426(31)21(1827)16221930(23115361223)2825(22)201091324(1720)35(3233)29147481529h356913161719H24781415H21H3b2116+
MFCD18076068
ZINC000002429094
ZINC02429094
ZINC2429094
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