Vitas-M small molecule compound
methyl 5-methyl-7-[4-(methylsulfanyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK977210
SMILES COC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)SC)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 C15H16N4O2S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O2S/c1-9-12(14(20)21-2)13(19-15(18-9)16-8-17-19)10-4-6-11(22-3)7-5-10/h4-8,13H,1-3H3,(H,16,17,18)InChIKey
UTSVJOIKWBZRHF-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=CC=C(C=C3)SC)C(=O)OC
InChI=1SC15H16N4O2Sc1912(14(20)212)13(1915(189)1681719)104611(223)7510h4813H13H3(H161718)
methyl5methyl7(4(methylsulfanyl)phenyl)47dihydro(124)triazolo(15a)pyrimidine6carboxylate
methyl5methyl7(4methylsulfanylphenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxylate
MFCD18181160
ZINC000044965543
ZINC000044965545
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