Vitas-M small molecule compound

8-chloro-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline

Catalog ID
STK721337
SMILES CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3Cl)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 C17H18ClN3S MW 331.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3S/c1-9(2)7-12-10-5-3-4-6-11(10)13-14-15(22-17(13)21-12)16(18)20-8-19-14/h8-9H,3-7H2,1-2H3
InChIKey
OTPRCMWLHIERAI-UHFFFAOYSA-N
Synonyms
371232-27-8
371232278
8chloro5(2methylpropyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8chloro5isobutyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CC(C)CC1=C2CCCCC2=C3C4=C(C(=NC=N4)Cl)SC3=N1
InChI=1SC17H18ClN3Sc19(2)71210534611(10)131415(2217(13)2112)16(18)2081914h89H37H212H3
MFCD03006692
ZINC000000535156
ZINC00535156
ZINC535156

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Available files

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