Vitas-M small molecule compound
2-[(4-hydroxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-1-(2,4,6-trimethylphenyl)ethanone
Catalog ID
STK913900
SMILES Cc1cc(C)c(c(c1)C)C(=O)CSc1nc(O)c2c(n1)sc1c2CCCC1
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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 C21H22N2O2S2 MW 398.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S2/c1-11-8-12(2)17(13(3)9-11)15(24)10-26-21-22-19(25)18-14-6-4-5-7-16(14)27-20(18)23-21/h8-9H,4-7,10H2,1-3H3,(H,22,23,25)InChIKey
GDBSFXSDQOCJDK-UHFFFAOYSA-NSynonyms
2((4hydroxy5678tetrahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)1(246trimethylphenyl)ethanone
2(2oxo2(246trimethylphenyl)ethyl)sulfanyl5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CC1=CC(=C(C(=C1)C)C(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)C
InChI=1SC21H22N2O2S2c111812(2)17(13(3)911)15(24)1026212219(25)1814645716(14)2720(18)2321h89H4710H213H3(H222325)
MFCD03641867
ZINC000018023966
ZINC18023966
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