Vitas-M small molecule compound
(2E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(3-methoxypropyl)prop-2-enamide
Catalog ID
STK702014
SMILES COCCCNC(=O)/C(=C/c1cn(nc1c1ccc(c(c1)C)OCC)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 C26H28N4O3 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3/c1-4-33-24-12-11-20(15-19(24)2)25-22(18-30(29-25)23-9-6-5-7-10-23)16-21(17-27)26(31)28-13-8-14-32-3/h5-7,9-12,15-16,18H,4,8,13-14H2,1-3H3,(H,28,31)/b21-16+InChIKey
XDPTZVKYFZRIRY-LTGZKZEYSA-NSynonyms
(2E)2cyano3(3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)N(3methoxypropyl)prop2enamide
(E)2cyano3(3(4ethoxy3methylphenyl)1phenyl1Hpyrazol4yl)N(3methoxypropyl)acrylamide
(E)2CYANO3(3(4ETHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)N(3METHOXYPROPYL)PROP2ENAMIDE
CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCCCOC)C3=CC=CC=C3)C
COCCCNC(=O)C(=Cc1cn(nc1c1ccc(c(c1)C)OCC)c1ccccc1)C#N
InChI=1SC26H28N4O3c143324121120(1519(24)2)2522(1830(2925)2396571023)1621(1727)26(31)2813814323h57912151618H481314H213H3(H2831)b2116+
MFCD02989175
ZINC000013800151
ZINC13800151
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