Vitas-M small molecule compound

5-phenyl-3-(propylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine

Catalog ID
STK548752
SMILES CCCSc1nnc2n1c(nc1c2c2CCCc2s1)c1ccccc1

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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 C19H18N4S2 MW 366.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4S2/c1-2-11-24-19-22-21-17-15-13-9-6-10-14(13)25-18(15)20-16(23(17)19)12-7-4-3-5-8-12/h3-5,7-8H,2,6,9-11H2,1H3
InChIKey
HNHZBUGTOAKROZ-UHFFFAOYSA-N
Synonyms
488108-19-6
488108196
5phenyl3(propylsulfanyl)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidine
5phenyl3(propylthio)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidine
CCCSC1=NN=C2N1C(=NC3=C2C4=C(S3)CCC4)C5=CC=CC=C5
InChI=1SC19H18N4S2c121124192221171513961014(13)2518(15)2016(23(17)19)127435812h3578H26911H21H3
MFCD03288912
ZINC000002328886
ZINC02328886
ZINC2328886

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.