Vitas-M small molecule compound
ethyl [(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]acetate
Catalog ID
STK532139
SMILES CCOC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)CCC
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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 C20H23N3O2S2 MW 401.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O2S2/c1-3-7-14-12-8-5-6-9-13(12)16-17-18(27-19(16)23-14)20(22-11-21-17)26-10-15(24)25-4-2/h11H,3-10H2,1-2H3InChIKey
KYKYGJYWRAPAOB-UHFFFAOYSA-NSynonyms
CCCC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC(=O)OCC)SC3=N1
ethyl((5propyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetate
ethyl2((5propyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetate
InChI=1SC20H23N3O2S2c1371412856913(12)161718(2719(16)2314)20(22112117)261015(24)2542h11H310H212H3
MFCD02237515
ZINC000001306385
ZINC01306385
ZINC1306385
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