Vitas-M small molecule compound
2-[(3-methylbutyl)sulfanyl]-3-(4-methylphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK831442
SMILES CC(CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCC3)C
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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 C21H24N2OS2 MW 384.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2OS2/c1-13(2)11-12-25-21-22-19-18(16-5-4-6-17(16)26-19)20(24)23(21)15-9-7-14(3)8-10-15/h7-10,13H,4-6,11-12H2,1-3H3InChIKey
TVIPQOWCJHDHPC-UHFFFAOYSA-NSynonyms
351160-81-12((3methylbutyl)sulfanyl)3(4methylphenyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
2(isopentylthio)3(ptolyl)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
3(3methylbutylsulfanyl)2(4methylphenyl)78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
351160811
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCC(C)C)SC4=C3CCC4
InChI=1SC21H24N2OS2c113(2)11122521221918(1654617(16)2619)20(24)23(21)159714(3)81015h71013H461112H213H3
MFCD01956207
ZINC000004438455
ZINC04438455
ZINC4438455
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