Vitas-M small molecule compound
ethyl [(5-phenyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]acetate
Catalog ID
STK721264
SMILES CCOC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)c1ccccc1
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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 C23H21N3O2S2 MW 435.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S2/c1-2-28-17(27)12-29-23-21-20(24-13-25-23)18-15-10-6-7-11-16(15)19(26-22(18)30-21)14-8-4-3-5-9-14/h3-5,8-9,13H,2,6-7,10-12H2,1H3InChIKey
GLASFZRWVXWJTL-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)C5=CC=CC=C5
ethyl((5phenyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetate
ethyl2((5phenyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetate
InChI=1SC23H21N3O2S2c122817(27)1229232120(24132523)181510671116(15)19(2622(18)3021)148435914h358913H2671012H21H3
MFCD02993365
ZINC000009008845
ZINC09008845
ZINC9008845
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