Vitas-M small molecule compound

ethyl 2-(4-hydroxy-3-iodo-5-methoxyphenyl)-4-oxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate

Catalog ID
STK382093
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=O)NC(N1)c1cc(I)c(c(c1)OC)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 C19H20IN3O5S MW 529.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20IN3O5S/c1-3-28-19(26)23-5-4-10-13(8-23)29-18-14(10)17(25)21-16(22-18)9-6-11(20)15(24)12(7-9)27-2/h6-7,16,22,24H,3-5,8H2,1-2H3,(H,21,25)
InChIKey
OODDTBIAASCDEV-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C(=C4)I)O)OC
ethyl2(4hydroxy3iodo5methoxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
ethyl2(4hydroxy3iodo5methoxyphenyl)4oxo134568hexahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
InChI=1SC19H20IN3O5Sc132819(26)23541013(823)291814(10)17(25)2116(2218)9611(20)15(24)12(79)272h67162224H358H212H3(H2125)
MFCD02915405
ZINC000102079861
ZINC000102079864

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Available files

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