Vitas-M small molecule compound
2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-8,9-dimethyl-7-(pyridin-4-ylmethyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK613100
SMILES Cc1c(C)c2c(n1Cc1ccncc1)ncn1c2nc(n1)CSc1nc2c(o1)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 C23H19N7OS MW 441.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N7OS/c1-14-15(2)29(11-16-7-9-24-10-8-16)21-20(14)22-27-19(28-30(22)13-25-21)12-32-23-26-17-5-3-4-6-18(17)31-23/h3-10,13H,11-12H2,1-2H3InChIKey
JSMQCQSUFKUTJB-UHFFFAOYSA-NSynonyms
921090-08-62(((89dimethyl7(pyridin4ylmethyl)7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)thio)benzo(d)oxazole
2((13benzoxazol2ylsulfanyl)methyl)89dimethyl7(pyridin4ylmethyl)7Hpyrrolo(32e)(124)triazolo(15c)pyrimidine
921090086
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CSC4=NC5=CC=CC=C5O4)CC6=CC=NC=C6)C
InChI=1SC23H19N7OSc11415(2)29(1116792410816)2120(14)222719(2830(22)132521)1232232617534618(17)3123h31013H1112H212H3
MFCD08748264
ZINC000009340693
ZINC09340693
ZINC9340693
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