Vitas-M small molecule compound
ethyl 2-(3-ethoxy-2-hydroxyphenyl)-4-hydroxy-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK383956
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1cccc(c1O)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/c1-3-27-13-7-5-6-12(16(13)24)17-21-18(25)15-11-8-9-23(20(26)28-4-2)10-14(11)29-19(15)22-17/h5-7,17,22,24H,3-4,8-10H2,1-2H3,(H,21,25)InChIKey
GBWYURVTVRUBTM-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC(=C1O)C2NC3=C(C4=C(S3)CN(CC4)C(=O)OCC)C(=O)N2
ethyl2(3ethoxy2hydroxyphenyl)4hydroxy1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(3ethoxy2hydroxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
InChI=1SC20H23N3O5Sc13271375612(16(13)24)172118(25)15118923(20(26)2842)1014(11)2919(15)2217h57172224H34810H212H3(H2125)
MFCD03837030
ZINC000004554826
ZINC000004554827
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