Vitas-M small molecule compound

3-({5-[(3-methylbutyl)sulfanyl]-1,3,4-oxadiazol-2-yl}methyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK660173
SMILES CC(CCSc1nnc(o1)Cn1cnc2c(c1=O)c1CCCc1s2)C

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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 C17H20N4O2S2 MW 376.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O2S2/c1-10(2)6-7-24-17-20-19-13(23-17)8-21-9-18-15-14(16(21)22)11-4-3-5-12(11)25-15/h9-10H,3-8H2,1-2H3
InChIKey
WJRSHPBTNSWSPB-UHFFFAOYSA-N
Synonyms
1144472-31-0
2((5(3methylbutylsulfanyl)134oxadiazol2yl)methyl)78dihydro6Hcyclopenta(23)thieno(24d)pyrimidin1one
3((5((3methylbutyl)sulfanyl)134oxadiazol2yl)methyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
3((5(isopentylthio)134oxadiazol2yl)methyl)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
CC(C)CCSC1=NN=C(O1)CN2C=NC3=C(C2=O)C4=C(S3)CCC4
Registry IDs
MFCD12212204
ZINC000032074178
ZINC32074178

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Available files

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