Vitas-M small molecule compound
methyl [(5-ethyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]acetate
Catalog ID
STK525425
SMILES COC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)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 C18H19N3O2S2 MW 373.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O2S2/c1-3-12-10-6-4-5-7-11(10)14-15-16(25-17(14)21-12)18(20-9-19-15)24-8-13(22)23-2/h9H,3-8H2,1-2H3InChIKey
KRNGQLQGXRMGPK-UHFFFAOYSA-NSynonyms
CCC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC(=O)OC)SC3=N1
InChI=1SC18H19N3O2S2c131210645711(10)141516(2517(14)2112)18(2091915)24813(22)232h9H38H212H3
methyl((5ethyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetate
methyl2((5ethyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetate
MFCD01958638
ZINC000002287704
ZINC02287704
ZINC2287704
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