Vitas-M small molecule compound
methyl ({7-methyl-6-[2-(piperidin-1-yl)pyrimidin-4-yl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetate
Catalog ID
STL121998
SMILES COC(=O)CSc1nn2c(n1)ncc(c2C)c1ccnc(n1)N1CCCCC1
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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 C18H21N7O2S MW 399.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N7O2S/c1-12-13(14-6-7-19-16(21-14)24-8-4-3-5-9-24)10-20-17-22-18(23-25(12)17)28-11-15(26)27-2/h6-7,10H,3-5,8-9,11H2,1-2H3InChIKey
HZDFYIDMOZDCCG-UHFFFAOYSA-NSynonyms
1282094-85-21282094852
CC1=C(C=NC2=NC(=NN12)SCC(=O)OC)C3=NC(=NC=C3)N4CCCCC4
InChI=1SC18H21N7O2Sc11213(14671916(2114)248435924)1020172218(2325(12)17)281115(26)272h6710H358911H212H3
methyl((7methyl6(2(piperidin1yl)pyrimidin4yl)(124)triazolo(15a)pyrimidin2yl)sulfanyl)acetate
methyl2((7methyl6(2(piperidin1yl)pyrimidin4yl)(124)triazolo(15a)pyrimidin2yl)thio)acetate
methyl2((7methyl6(2piperidin1ylpyrimidin4yl)(124)triazolo(15a)pyrimidin2yl)sulfanyl)acetate
MFCD18798747
ZINC000054201962
ZINC54201962
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