Vitas-M small molecule compound
1-[(2-chlorobenzyl)sulfanyl]-4-ethyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK555276
SMILES CCn1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCc1ccccc1Cl
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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 C20H19ClN4OS2 MW 430.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4OS2/c1-2-24-17(26)16-13-8-4-6-10-15(13)28-18(16)25-19(24)22-23-20(25)27-11-12-7-3-5-9-14(12)21/h3,5,7,9H,2,4,6,8,10-11H2,1H3InChIKey
JCSXOIHCHJVYCA-UHFFFAOYSA-NSynonyms
840514-57-01((2chlorobenzyl)sulfanyl)4ethyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((2chlorobenzyl)thio)4ethyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
840514570
CCN1C(=O)C2=C(N3C1=NN=C3SCC4=CC=CC=C4Cl)SC5=C2CCCC5
InChI=1SC20H19ClN4OS2c122417(26)16138461015(13)2818(16)2519(24)222320(25)271112735914(12)21h3579H24681011H21H3
MFCD04010095
ZINC000002343351
ZINC02343351
ZINC2343351
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