Vitas-M small molecule compound
methyl 7-{4-[(4-fluorobenzyl)oxy]phenyl}-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK323362
SMILES COC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)OCc1ccc(cc1)F)ncn2
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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 C21H19FN4O3 MW 394.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN4O3/c1-13-18(20(27)28-2)19(26-21(25-13)23-12-24-26)15-5-9-17(10-6-15)29-11-14-3-7-16(22)8-4-14/h3-10,12,19H,11H2,1-2H3,(H,23,24,25)InChIKey
HGZRLLOJOMNTNM-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=CC=C(C=C3)OCC4=CC=C(C=C4)F)C(=O)OC
InChI=1SC21H19FN4O3c11318(20(27)282)19(2621(2513)23122426)155917(10615)2911143716(22)8414h3101219H11H212H3(H232425)
METHYL7(4((4FLUOROBENZYL)OXY)PHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
methyl7(4((4fluorophenyl)methoxy)phenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxylate
MFCD04511631
ZINC000012655544
ZINC000012655547
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