Vitas-M small molecule compound
2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-7-(3-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK945166
SMILES COc1cccc(c1)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(16-7-6-8-17(11-16)31-3)22-21(14)23-27-20(28-29(23)13-25-22)12-32-24-26-18-9-4-5-10-19(18)33-24/h4-11,13H,12H2,1-3H3InChIKey
WFJHMBKBBNNKHM-UHFFFAOYSA-NSynonyms
950323-90-72((13benzothiazol2ylsulfanyl)methyl)7(3methoxyphenyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidine
950323907
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CSC4=NC5=CC=CC=C5S4)C6=CC(=CC=C6)OC)C
InChI=1SC24H20N6OS2c11415(2)30(1676817(1116)313)2221(14)232720(2829(23)132522)12322426189451019(18)3324h41113H12H213H3
MFCD14830717
ZINC000015842258
ZINC15842258
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