Vitas-M small molecule compound

5-butyl-8-(prop-2-en-1-ylsulfanyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline

Catalog ID
STK830185
SMILES CCCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC=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 C20H23N3S2 MW 369.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3S2/c1-3-5-10-15-13-8-6-7-9-14(13)16-17-18(25-19(16)23-15)20(22-12-21-17)24-11-4-2/h4,12H,2-3,5-11H2,1H3
InChIKey
VLCSAZAPOLXBHU-UHFFFAOYSA-N
Synonyms
373616-54-7
373616547
5butyl8(prop2en1ylsulfanyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8(allylthio)5butyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CCCCC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC=C)SC3=N1
InChI=1SC20H23N3S2c135101513867914(13)161718(2519(16)2315)20(22122117)241142h412H23511H21H3
MFCD01948452
ZINC000002281484
ZINC02281484
ZINC2281484

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Available files

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