Vitas-M small molecule compound
ethyl 2-(3-ethoxy-4-hydroxyphenyl)-4-oxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK382098
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(c(c1)OCC)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 C20H23N3O5S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O5S/c1-3-27-14-9-11(5-6-13(14)24)17-21-18(25)16-12-7-8-23(20(26)28-4-2)10-15(12)29-19(16)22-17/h5-6,9,17,22,24H,3-4,7-8,10H2,1-2H3,(H,21,25)InChIKey
YBLYLOFYZCTXCP-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2NC3=C(C4=C(S3)CN(CC4)C(=O)OCC)C(=O)N2)O
ethyl2(3ethoxy4hydroxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
ethyl2(3ethoxy4hydroxyphenyl)4oxo134568hexahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
InChI=1SC20H23N3O5Sc132714911(5613(14)24)172118(25)16127823(20(26)2842)1015(12)2919(16)2217h569172224H347810H212H3(H2125)
MFCD02915410
ZINC000004543258
ZINC000004543259
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