Vitas-M small molecule compound
methyl {[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetate
Catalog ID
STK836267
SMILES COC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1
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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 C20H22N4O3S2 MW 430.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S2/c1-26-14(25)10-28-20-17-16(21-11-22-20)15-12-4-2-3-5-13(12)18(23-19(15)29-17)24-6-8-27-9-7-24/h11H,2-10H2,1H3InChIKey
MBIKWKCJOBYLIT-UHFFFAOYSA-NSynonyms
COC(=O)CSC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)N5CCOCC5
InChI=1SC20H22N4O3S2c12614(25)1028201716(21112220)1512423513(12)18(2319(15)2917)2468279724h11H210H21H3
methyl((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetate
methyl2((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetate
MFCD02996007
ZINC000020024623
ZINC20024623
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