Vitas-M small molecule compound

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

Catalog ID
STK524771
SMILES CCCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=C)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 C21H25N3S2 MW 383.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3S2/c1-4-5-10-16-14-8-6-7-9-15(14)17-18-19(26-20(17)24-16)21(23-12-22-18)25-11-13(2)3/h12H,2,4-11H2,1,3H3
InChIKey
UIXKJFWMEBFDGH-UHFFFAOYSA-N
Synonyms
374546-42-6
374546426
5butyl8((2methylallyl)thio)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
5butyl8((2methylprop2en1yl)sulfanyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CCCCC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC(=C)C)SC3=N1
InChI=1SC21H25N3S2c145101614867915(14)171819(2620(17)2416)21(23122218)251113(2)3h12H2411H213H3
MFCD01956297
ZINC000004822795
ZINC04822795
ZINC4822795

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Available files

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