Vitas-M small molecule compound
2-[1-(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)ethyl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK725312
SMILES CC(N1C(=O)c2c(C1=O)cccc2)c1nn2c(n1)c1c(nc2)sc2c1CCCC2
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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 C21H17N5O2S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O2S/c1-11(26-20(27)12-6-2-3-7-13(12)21(26)28)17-23-18-16-14-8-4-5-9-15(14)29-19(16)22-10-25(18)24-17/h2-3,6-7,10-11H,4-5,8-9H2,1H3InChIKey
QECNHQWSWITQOE-UHFFFAOYSA-NSynonyms
900288-41-72(1(891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidin2yl)ethyl)1Hisoindole13(2H)dione
2(1(891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(15c)pyrimidin2yl)ethyl)isoindoline13dione
900288417
CC(C1=NN2C=NC3=C(C2=N1)C4=C(S3)CCCC4)N5C(=O)C6=CC=CC=C6C5=O
InChI=1SC21H17N5O2Sc111(2620(27)12623713(12)21(26)28)1723181614845915(14)2919(16)221025(18)2417h23671011H4589H21H3
MFCD06613718
ZINC000002364268
ZINC000002364270
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