Vitas-M small molecule compound
ethyl 4-({[7-(4-cyanophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]carbonyl}amino)benzoate
Catalog ID
STL091339
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)C#N)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 C23H20N6O3 MW 428.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N6O3/c1-3-32-22(31)17-8-10-18(11-9-17)28-21(30)19-14(2)27-23-25-13-26-29(23)20(19)16-6-4-15(12-24)5-7-16/h4-11,13,20H,3H2,1-2H3,(H,28,30)(H,25,26,27)InChIKey
VQFOAXMKNKZUEL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N=C3N=CNN3C2C4=CC=C(C=C4)C#N)C
ethyl4(((7(4cyanophenyl)5methyl47dihydro(124)triazolo(15a)pyrimidin6yl)carbonyl)amino)benzoate
ETHYL4((7(4CYANOPHENYL)5METHYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBONYL)AMINO)BENZOATE
InChI=1SC23H20N6O3c133222(31)1781018(11917)2821(30)1914(2)272325132629(23)20(19)166415(1224)5716h4111320H3H212H3(H2830)(H252627)
MFCD03997455
ZINC000000944380
ZINC000000944381
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