Vitas-M small molecule compound
ethyl 7-(3-chloro-4-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STL181662
SMILES CCOC(=O)C1=C(C)Nc2n(C1c1ccc(c(c1)Cl)OC)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 C16H17ClN4O3 MW 348.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O3/c1-4-24-15(22)13-9(2)20-16-18-8-19-21(16)14(13)10-5-6-12(23-3)11(17)7-10/h5-8,14H,4H2,1-3H3,(H,18,19,20)InChIKey
ANSQJRUXYQCXBM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2N=CNN2C1C3=CC(=C(C=C3)OC)Cl)C
ethyl7(3chloro4methoxyphenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxylate
ethyl7(3chloro4methoxyphenyl)5methyl47dihydro(124)triazolo(15a)pyrimidine6carboxylate
InChI=1SC16H17ClN4O3c142415(22)139(2)20161881921(16)14(13)105612(233)11(17)710h5814H4H213H3(H181920)
MFCD08556692
ZINC000036615187
ZINC000036615188
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