Vitas-M small molecule compound
ethyl 2-[(6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK579245
SMILES CCOC(=O)c1sc2c(c1C)c(=O)[nH]c(n2)CN1CCc2c(C1C)cc(c(c2)OC)OC
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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 C23H27N3O5S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O5S/c1-6-31-23(28)20-12(2)19-21(27)24-18(25-22(19)32-20)11-26-8-7-14-9-16(29-4)17(30-5)10-15(14)13(26)3/h9-10,13H,6-8,11H2,1-5H3,(H,24,25,27)InChIKey
YQAWYSFBHYXRGA-UHFFFAOYSA-NSynonyms
879776-45-1879776451
CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CN3CCC4=CC(=C(C=C4C3C)OC)OC)C
CCOC(=O)c1sc2c(c1C)c(=O)(nH)c(n2)CN1CCc2c(C1C)cc(c(c2)OC)OC
ethyl2((67dimethoxy1methyl34dihydro1Hisoquinolin2yl)methyl)5methyl4oxo3Hthieno(23d)pyrimidine6carboxylate
ETHYL2((67DIMETHOXY1METHYL34DIHYDRO2(1H)ISOQUINOLINYL)METHYL)5METHYL4OXO34DIHYDROTHIENO(23D)PYRIMIDINE6CARBOXYLATE
ethyl2((67dimethoxy1methyl34dihydroisoquinolin2(1H)yl)methyl)5methyl4oxo34dihydrothieno(23d)pyrimidine6carboxylate
InChI=1SC23H27N3O5Sc163123(28)2012(2)1921(27)2418(2522(19)3220)11268714916(294)17(305)1015(14)13(26)3h91013H6811H215H3(H242527)
MFCD07639862
ZINC000013591369
ZINC000017043972
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