Vitas-M small molecule compound

8-(piperidin-1-yl)-5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline

Catalog ID
STK830237
SMILES CC(c1nc2sc3c(c2c2c1CCCC2)ncnc3N1CCCCC1)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 C21H26N4S MW 366.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4S/c1-13(2)17-15-9-5-4-8-14(15)16-18-19(26-21(16)24-17)20(23-12-22-18)25-10-6-3-7-11-25/h12-13H,3-11H2,1-2H3
InChIKey
DTIJTIQOWNZCMK-UHFFFAOYSA-N
Synonyms

5isopropyl8(piperidin1yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8(piperidin1yl)5(propan2yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CC(C)C1=C2CCCCC2=C3C4=C(C(=NC=N4)N5CCCCC5)SC3=N1
InChI=1SC21H26N4Sc113(2)1715954814(15)161819(2621(16)2417)20(23122218)25106371125h1213H311H212H3
MFCD02237541
ZINC000001300585
ZINC01300585
ZINC1300585

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Available files

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