Vitas-M small molecule compound

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

Catalog ID
STK384522
SMILES CCN1CCc2c(C1)sc1c2C(=NC(N1)c1cccc2c1cccc2)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 C21H21N3OS MW 363.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3OS/c1-2-24-11-10-16-17(12-24)26-21-18(16)20(25)22-19(23-21)15-9-5-7-13-6-3-4-8-14(13)15/h3-9,19,23H,2,10-12H2,1H3,(H,22,25)
InChIKey
SKXFROFUGNUYEG-UHFFFAOYSA-N
Synonyms

7ethyl2(naphthalen1yl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
7ethyl2naphthalen1yl123568hexahydropyrido(23)thieno(24d)pyrimidin4one
CCN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=CC5=CC=CC=C54
InChI=1SC21H21N3OSc122411101617(1224)262118(16)20(25)2219(2321)1595713634814(13)15h391923H21012H21H3(H2225)
MFCD04042202
ZINC000004556143
ZINC000004556144

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Available files

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