Vitas-M small molecule compound

4-butyl-7-(butylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine

Catalog ID
STK721492
SMILES CCCCSc1ncnc2c1sc1c2c2CCCc2c(n1)CCCC

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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 C20H25N3S2 MW 371.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3S2/c1-3-5-10-15-13-8-7-9-14(13)16-17-18(25-19(16)23-15)20(22-12-21-17)24-11-6-4-2/h12H,3-11H2,1-2H3
InChIKey
NNCXPZKZKAQTCT-UHFFFAOYSA-N
Synonyms
487030-19-3
487030193
4butyl7(butylsulfanyl)23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
4butyl7(butylthio)23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
CCCCC1=C2CCCC2=C3C4=C(C(=NC=N4)SCCCC)SC3=N1
InChI=1SC20H25N3S2c13510151387914(13)161718(2519(16)2315)20(22122117)2411642h12H311H212H3
MFCD03286836
ZINC000002321519
ZINC02321519
ZINC2321519

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Available files

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