Vitas-M small molecule compound

3-cyclohexyl-2-(ethylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one

Catalog ID
STK055609
SMILES CCSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCC3

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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 C17H22N2OS2 MW 334.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2OS2/c1-2-21-17-18-15-14(12-9-6-10-13(12)22-15)16(20)19(17)11-7-4-3-5-8-11/h11H,2-10H2,1H3
InChIKey
GWPDUTJTKTXVGS-UHFFFAOYSA-N
Synonyms
351342-15-9
2cyclohexyl3ethylsulfanyl78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
351342159
3cyclohexyl2(ethylsulfanyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
3cyclohexyl2(ethylthio)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
CCSC1=NC2=C(C3=C(S2)CCC3)C(=O)N1C4CCCCC4
CCSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCC3
InChI=1SC17H22N2OS2c122117181514(12961013(12)2215)16(20)19(17)117435811h11H210H21H3
MFCD01557577
STK055609
ZINC000000495789
ZINC00495789
ZINC495789

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Available files

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