Vitas-M small molecule compound

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

Catalog ID
STK721245
SMILES CCN(CCNc1ncnc2c1sc1c2c2CCCCc2c(n1)c1ccco1)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 C23H27N5OS MW 421.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5OS/c1-3-28(4-2)12-11-24-22-21-20(25-14-26-22)18-15-8-5-6-9-16(15)19(27-23(18)30-21)17-10-7-13-29-17/h7,10,13-14H,3-6,8-9,11-12H2,1-2H3,(H,24,25,26)
InChIKey
VQXWYGNBHFCFQG-UHFFFAOYSA-N
Synonyms
373368-76-4
373368764
CCN(CC)CCNC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)C5=CC=CO5
InChI=1SC23H27N5OSc1328(42)121124222120(25142622)1815856916(15)19(2723(18)3021)17107132917h7101314H36891112H212H3(H242526)
MFCD01945749
N1N1diethylN2(5(furan2yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)ethane12diamine
NNdiethylN(5(furan2yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)ethane12diamine
ZINC000002279497
ZINC2279497

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Available files

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