Vitas-M small molecule compound
3-[(2E)-3-(1',5'-dimethyl-1-phenyl-1H,1'H-3,4'-bipyrazol-4-yl)prop-2-enoyl]-2H-chromen-2-one
Catalog ID
STL181752
SMILES Cc1n(C)ncc1c1nn(cc1/C=C/C(=O)c1cc2ccccc2oc1=O)c1ccccc1
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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 C26H20N4O3 MW 436.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N4O3/c1-17-22(15-27-29(17)2)25-19(16-30(28-25)20-9-4-3-5-10-20)12-13-23(31)21-14-18-8-6-7-11-24(18)33-26(21)32/h3-16H,1-2H3/b13-12+InChIKey
VZHCDFGEWPOOQM-OUKQBFOZSA-NSynonyms
1263038-37-41263038374
3((2E)3(15dimethyl1phenyl1H1H34bipyrazol4yl)prop2enoyl)2Hchromen2one
3((2E)3(3(15DIMETHYLPYRAZOL4YL)1PHENYLPYRAZOL4YL)PROP2ENOYL)CHROMEN2ONE
3((E)3(3(15dimethylpyrazol4yl)1phenylpyrazol4yl)prop2enoyl)chromen2one
CC1=C(C=NN1C)C2=NN(C=C2C=CC(=O)C3=CC4=CC=CC=C4OC3=O)C5=CC=CC=C5
Cc1n(C)ncc1c1nn(cc1C=CC(=O)c1cc2ccccc2oc1=O)c1ccccc1
InChI=1SC26H20N4O3c11722(152729(17)2)2519(1630(2825)2094351020)121323(31)2114188671124(18)3326(21)32h316H12H3b1312+
MFCD20760125
ZINC000071785136
ZINC71785136
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