Vitas-M small molecule compound
methyl {[5-(benzylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetate
Catalog ID
STK720422
SMILES COC(=O)CSc1nnc2n1c(SCc1ccccc1)nc1c2c2CCCc2s1
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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 C20H18N4O2S3 MW 442.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O2S3/c1-26-15(25)11-28-20-23-22-17-16-13-8-5-9-14(13)29-18(16)21-19(24(17)20)27-10-12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3InChIKey
DEABZPYADIZENG-UHFFFAOYSA-NSynonyms
585556-86-1585556861
COC(=O)CSC1=NN=C2N1C(=NC3=C2C4=C(S3)CCC4)SCC5=CC=CC=C5
InChI=1SC20H18N4O2S3c12615(25)112820232217161385914(13)2918(16)2119(24(17)20)2710126324712h2467H5811H21H3
methyl((5(benzylsulfanyl)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetate
methyl2((5(benzylthio)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetate
MFCD04028297
ZINC000002383724
ZINC02383724
ZINC2383724
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