Vitas-M small molecule compound
(2E)-2-cyano-N-(4-ethoxyphenyl)-3-[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STK701470
SMILES CCOc1ccc(cc1)NC(=O)/C(=C/c1cn(nc1c1ccc(cc1)F)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 C27H21FN4O2 MW 452.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21FN4O2/c1-2-34-25-14-12-23(13-15-25)30-27(33)20(17-29)16-21-18-32(24-6-4-3-5-7-24)31-26(21)19-8-10-22(28)11-9-19/h3-16,18H,2H2,1H3,(H,30,33)/b20-16+InChIKey
QKZHSFBFIPJNSX-CAPFRKAQSA-NSynonyms
(2E)2cyanoN(4ethoxyphenyl)3(3(4fluorophenyl)1phenyl1Hpyrazol4yl)prop2enamide
(E)2CYANON(4ETHOXYPHENYL)3(3(4FLUOROPHENYL)1PHENYLPYRAZOL4YL)PROP2ENAMIDE
CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4)C#N
CCOc1ccc(cc1)NC(=O)C(=Cc1cn(nc1c1ccc(cc1)F)c1ccccc1)C#N
InChI=1SC27H21FN4O2c123425141223(131525)3027(33)20(1729)16211832(246435724)3126(21)1981022(28)11919h31618H2H21H3(H3033)b2016+
MFCD03461477
ZINC000001452671
ZINC01452671
ZINC1452671
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