Vitas-M small molecule compound
2-amino-4-[1-(2,4-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK972199
SMILES N#CC1=C(N)OC2=C(C1c1cn(nc1c1ccccc1)Cc1ccc(cc1Cl)Cl)C(=O)CCC2
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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 C26H20Cl2N4O2 MW 491.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20Cl2N4O2/c27-17-10-9-16(20(28)11-17)13-32-14-19(25(31-32)15-5-2-1-3-6-15)23-18(12-29)26(30)34-22-8-4-7-21(33)24(22)23/h1-3,5-6,9-11,14,23H,4,7-8,13,30H2InChIKey
KUCOKFVSMSAZIU-UHFFFAOYSA-NSynonyms
492425-28-22amino4(1((24dichlorophenyl)methyl)3phenylpyrazol4yl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(1(24dichlorobenzyl)3phenyl1Hpyrazol4yl)5oxo5678tetrahydro4Hchromene3carbonitrile
492425282
C1CC2=C(C(C(=C(O2)N)C#N)C3=CN(N=C3C4=CC=CC=C4)CC5=C(C=C(C=C5)Cl)Cl)C(=O)C1
InChI=1SC26H20Cl2N4O2c271710916(20(28)1117)13321419(25(3132)155213615)2318(1229)26(30)342284721(33)24(22)23h13569111423H4781330H2
MFCD02175108
ZINC000002759003
ZINC000002759004
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