Vitas-M small molecule compound
3-(4-ethylphenyl)-2-sulfanyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK438997
SMILES CCc1ccc(cc1)n1c(S)nc2c(c1=O)c1CCCc1s2
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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 C17H16N2OS2 MW 328.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2OS2/c1-2-10-6-8-11(9-7-10)19-16(20)14-12-4-3-5-13(12)22-15(14)18-17(19)21/h6-9H,2-5H2,1H3,(H,18,21)InChIKey
RMXRUERDBULDGT-UHFFFAOYSA-NSynonyms
2(4ethylphenyl)3sulfanylidene4678tetrahydrocyclopenta(23)thieno(24b)pyrimidin1one
3(4ethylphenyl)2sulfanyl3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
CCC1=CC=C(C=C1)N2C(=O)C3=C(NC2=S)SC4=C3CCC4
InChI=1SC17H16N2OS2c12106811(9710)1916(20)141243513(12)2215(14)1817(19)21h69H25H21H3(H1821)
MFCD03945862
ZINC000017067333
ZINC17067333
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