Vitas-M small molecule compound
(2E)-2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-(2-hydroxyphenyl)prop-2-enamide
Catalog ID
STK952611
SMILES N#C/C(=C\c1ccccc1O)/C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C
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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 C21H18N4O3 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3/c1-14-19(21(28)25(24(14)2)17-9-4-3-5-10-17)23-20(27)16(13-22)12-15-8-6-7-11-18(15)26/h3-12,26H,1-2H3,(H,23,27)/b16-12+InChIKey
IULGPWUSUWETLY-FOWTUZBSSA-NSynonyms
(2E)2cyanoN(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)3(2hydroxyphenyl)prop2enamide
(2E)N(23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))2CYANO3(2HYDROXYPHENYL)PROP2ENAMIDE
(E)2CYANON(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)3(2HYDROXYPHENYL)PROP2ENAMIDE
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(=CC3=CC=CC=C3O)C#N
InChI=1SC21H18N4O3c11419(21(28)25(24(14)2)1794351017)2320(27)16(1322)12158671118(15)26h31226H12H3(H2327)b1612+
MFCD02353787
N#CC(=Cc1ccccc1O)C(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C
ZINC000001453574
ZINC01453574
ZINC1453574
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