Vitas-M small molecule compound

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

Catalog ID
STK381510
SMILES CCOC(=O)N1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccccc1O

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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 C18H19N3O4S MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4S/c1-2-25-18(24)21-8-7-11-13(9-21)26-17-14(11)16(23)19-15(20-17)10-5-3-4-6-12(10)22/h3-6,15,20,22H,2,7-9H2,1H3,(H,19,23)
InChIKey
AUEZELBAMVKWSY-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=CC=C4O
ethyl2(2hydroxyphenyl)4oxo123568hexahydropyrido(23)thieno(24d)pyrimidine7carboxylate
ethyl2(2hydroxyphenyl)4oxo134568hexahydropyrido(4345)thieno(23d)pyrimidine7(2H)carboxylate
InChI=1SC18H19N3O4Sc122518(24)21871113(921)261714(11)16(23)1915(2017)10534612(10)22h36152022H279H21H3(H1923)
MFCD02604116
ZINC000006732644
ZINC000006732646

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.