Vitas-M small molecule compound
pentyl {[5-(benzylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetate
Catalog ID
STK720400
SMILES CCCCCOC(=O)CSc1nnc2n1c(SCc1ccccc1)nc1c2c2CCCCc2s1
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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 C25H28N4O2S3 MW 512.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O2S3/c1-2-3-9-14-31-20(30)16-33-25-28-27-22-21-18-12-7-8-13-19(18)34-23(21)26-24(29(22)25)32-15-17-10-5-4-6-11-17/h4-6,10-11H,2-3,7-9,12-16H2,1H3InChIKey
LAXAZIMEVUSOJO-UHFFFAOYSA-NSynonyms
586994-71-0586994710
CCCCCOC(=O)CSC1=NN=C2N1C(=NC3=C2C4=C(S3)CCCC4)SCC5=CC=CC=C5
InChI=1SC25H28N4O2S3c1239143120(30)163325282722211812781319(18)3423(21)2624(29(22)25)321517105461117h461011H23791216H21H3
MFCD04031244
pentyl((5(benzylsulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetate
pentyl2((5(benzylthio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetate
ZINC000002394222
ZINC02394222
ZINC2394222
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