Vitas-M small molecule compound

N-benzyl-5-(furan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine

Catalog ID
STK830188
SMILES c1ccc(cc1)CNc1ncnc2c1sc1c2c2CCCCc2c(n1)c1ccco1

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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 C24H20N4OS MW 412.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4OS/c1-2-7-15(8-3-1)13-25-23-22-21(26-14-27-23)19-16-9-4-5-10-17(16)20(28-24(19)30-22)18-11-6-12-29-18/h1-3,6-8,11-12,14H,4-5,9-10,13H2,(H,25,26,27)
InChIKey
JJFCJYVTKOKEFK-UHFFFAOYSA-N
Synonyms

C1CCC2=C(N=C3C(=C2C1)C4=C(S3)C(=NC=N4)NCC5=CC=CC=C5)C6=CC=CO6
InChI=1SC24H20N4OSc12715(831)1325232221(26142723)19169451017(16)20(2824(19)3022)18116122918h1368111214H4591013H2(H252627)
MFCD01959086
Nbenzyl5(furan2yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8amine
ZINC000002288417
ZINC02288417
ZINC2288417

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Available files

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