Vitas-M small molecule compound
ethyl 2-(4-{[(4-chlorophenyl)carbonyl]oxy}phenyl)-4-hydroxy-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK384048
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(cc1)OC(=O)c1ccc(cc1)Cl)O
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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 C25H22ClN3O5S MW 511.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O5S/c1-2-33-25(32)29-12-11-18-19(13-29)35-23-20(18)22(30)27-21(28-23)14-5-9-17(10-6-14)34-24(31)15-3-7-16(26)8-4-15/h3-10,21,28H,2,11-13H2,1H3,(H,27,30)InChIKey
LUEYINBYTPCOJT-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(C=C4)OC(=O)C5=CC=C(C=C5)Cl
ethyl2(4(((4chlorophenyl)carbonyl)oxy)phenyl)4hydroxy1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(4(4chlorobenzoyl)oxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
InChI=1SC25H22ClN3O5Sc123325(32)2912111819(1329)352320(18)22(30)2721(2823)145917(10614)3424(31)153716(26)8415h3102128H21113H21H3(H2730)
MFCD03837325
ZINC000008921652
ZINC000008921656
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