Vitas-M small molecule compound
2-{1-[8,9-dimethyl-7-(2-methylpropyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-3-(methylsulfanyl)propyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK623410
SMILES CSCCC(N1C(=O)c2c(C1=O)cccc2)c1nc2n(n1)cnc1c2c(C)c(n1CC(C)C)C
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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 C25H28N6O2S MW 476.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O2S/c1-14(2)12-29-16(4)15(3)20-22(29)26-13-30-23(20)27-21(28-30)19(10-11-34-5)31-24(32)17-8-6-7-9-18(17)25(31)33/h6-9,13-14,19H,10-12H2,1-5H3InChIKey
GOFKWLSMSMURKN-UHFFFAOYSA-NSynonyms
921159-94-62(1(7isobutyl89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)3(methylthio)propyl)isoindoline13dione
2(1(89dimethyl7(2methylpropyl)7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)3(methylsulfanyl)propyl)1Hisoindole13(2H)dione
921159946
CC1=C(N(C2=C1C3=NC(=NN3C=N2)C(CCSC)N4C(=O)C5=CC=CC=C5C4=O)CC(C)C)C
InChI=1SC25H28N6O2Sc114(2)122916(4)15(3)2022(29)26133023(20)2721(2830)19(1011345)3124(32)17867918(17)25(31)33h69131419H1012H215H3
MFCD08750826
ZINC000009419911
ZINC000009419912
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