Vitas-M small molecule compound

N'-(5-butyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)-N,N-diethylethane-1,2-diamine

Catalog ID
STK531075
SMILES CCCCc1nc2sc3c(c2c2c1CCCC2)ncnc3NCCN(CC)CC

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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 C23H33N5S MW 411.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H33N5S/c1-4-7-12-18-16-10-8-9-11-17(16)19-20-21(29-23(19)27-18)22(26-15-25-20)24-13-14-28(5-2)6-3/h15H,4-14H2,1-3H3,(H,24,25,26)
InChIKey
LTTZSCFVWVCPOF-UHFFFAOYSA-N
Synonyms

CCCCC1=C2CCCCC2=C3C4=C(C(=NC=N4)NCCN(CC)CC)SC3=N1
InChI=1SC23H33N5Sc14712181610891117(16)192021(2923(19)2718)22(26152520)24131428(52)63h15H414H213H3(H242526)
MFCD02242224
N(5butyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)NNdiethylethane12diamine
N1(5butyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)N2N2diethylethane12diamine
ZINC000002299548
ZINC2299548

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Available files

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