Vitas-M small molecule compound
ethyl 2-{3-ethoxy-4-[(thiophen-2-ylcarbonyl)oxy]phenyl}-4-hydroxy-1,5,6,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Catalog ID
STK384012
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=NC(N1)c1ccc(c(c1)OCC)OC(=O)c1cccs1)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 C25H25N3O6S2 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O6S2/c1-3-32-17-12-14(7-8-16(17)34-24(30)18-6-5-11-35-18)21-26-22(29)20-15-9-10-28(25(31)33-4-2)13-19(15)36-23(20)27-21/h5-8,11-12,21,27H,3-4,9-10,13H2,1-2H3,(H,26,29)InChIKey
SUNWEFRSEZTVDF-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2NC3=C(C4=C(S3)CN(CC4)C(=O)OCC)C(=O)N2)OC(=O)C5=CC=CS5
ethyl2(3ethoxy4((thiophen2ylcarbonyl)oxy)phenyl)4hydroxy1568tetrahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
ethyl2(3ethoxy4(thiophene2carbonyloxy)phenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
InChI=1SC25H25N3O6S2c1332171214(7816(17)3424(30)1865113518)212622(29)201591028(25(31)3342)1319(15)3623(20)2721h5811122127H3491013H212H3(H2629)
MFCD03837189
ZINC000102093239
ZINC000102093243
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