Vitas-M small molecule compound
2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-7-(4-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK945293
SMILES COc1ccc(cc1)n1c2ncn3c(c2c(c1C)C)nc(n3)CSc1nc2c(s1)cccc2
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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 C24H20N6OS2 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N6OS2/c1-14-15(2)30(16-8-10-17(31-3)11-9-16)22-21(14)23-27-20(28-29(23)13-25-22)12-32-24-26-18-6-4-5-7-19(18)33-24/h4-11,13H,12H2,1-3H3InChIKey
LMWXQFVTIJPTJG-UHFFFAOYSA-NSynonyms
950433-71-32((13benzothiazol2ylsulfanyl)methyl)7(4methoxyphenyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidine
950433713
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CSC4=NC5=CC=CC=C5S4)C6=CC=C(C=C6)OC)C
InChI=1SC24H20N6OS2c11415(2)30(1681017(313)11916)2221(14)232720(2829(23)132522)1232242618645719(18)3324h41113H12H213H3
MFCD14830726
ZINC000015842262
ZINC15842262
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