Vitas-M small molecule compound
(2E)-3-(1-benzyl-3-phenyl-1H-pyrazol-4-yl)-2-cyano-N-(2,4-dimethoxyphenyl)prop-2-enamide
Catalog ID
STK435273
SMILES COc1ccc(c(c1)OC)NC(=O)/C(=C/c1cn(nc1c1ccccc1)Cc1ccccc1)/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 C28H24N4O3 MW 464.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O3/c1-34-24-13-14-25(26(16-24)35-2)30-28(33)22(17-29)15-23-19-32(18-20-9-5-3-6-10-20)31-27(23)21-11-7-4-8-12-21/h3-16,19H,18H2,1-2H3,(H,30,33)/b22-15+InChIKey
PZXKRESDUWMFJQ-PXLXIMEGSA-NSynonyms
(2E)3(1benzyl3phenyl1Hpyrazol4yl)2cyanoN(24dimethoxyphenyl)prop2enamide
(2E)N(24DIMETHOXYPHENYL)2CYANO3(3PHENYL1BENZYLPYRAZOL4YL)PROP2ENAMIDE
(E)3(1BENZYL3PHENYLPYRAZOL4YL)2CYANON(24DIMETHOXYPHENYL)PROP2ENAMIDE
COC1=CC(=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4)C#N)OC
COc1ccc(c(c1)OC)NC(=O)C(=Cc1cn(nc1c1ccccc1)Cc1ccccc1)C#N
InChI=1SC28H24N4O3c13424131425(26(1624)352)3028(33)22(1729)15231932(182095361020)3127(23)21117481221h31619H18H212H3(H3033)b2215+
MFCD03943686
ZINC000020247433
ZINC20247433
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