Vitas-M small molecule compound

7-ethyl-2-(2-hydroxy-3-methylphenyl)-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol

Catalog ID
STK384532
SMILES CCN1CCc2c(C1)sc1c2C(=NC(N1)c1cccc(c1O)C)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 C18H21N3O2S MW 343.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O2S/c1-3-21-8-7-11-13(9-21)24-18-14(11)17(23)19-16(20-18)12-6-4-5-10(2)15(12)22/h4-6,16,20,22H,3,7-9H2,1-2H3,(H,19,23)
InChIKey
NZHYPXLFJKFDJS-UHFFFAOYSA-N
Synonyms

7ethyl2(2hydroxy3methylphenyl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7ethyl2(2hydroxy3methylphenyl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
CCN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C(=CC=C4)C)O
InChI=1SC18H21N3O2Sc1321871113(921)241814(11)17(23)1916(2018)1264510(2)15(12)22h46162022H379H212H3(H1923)
MFCD04042211
ZINC000006654906
ZINC000006654914

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Available files

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