Vitas-M small molecule compound
1-(4-fluoro-3-methylphenyl)-2-[(4-hydroxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanone
Catalog ID
STK913902
SMILES O=C(c1ccc(c(c1)C)F)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 C19H17FN2O2S2 MW 388.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17FN2O2S2/c1-10-8-11(6-7-13(10)20)14(23)9-25-19-21-17(24)16-12-4-2-3-5-15(12)26-18(16)22-19/h6-8H,2-5,9H2,1H3,(H,21,22,24)InChIKey
ZVPJCYOVCXTWCT-UHFFFAOYSA-NSynonyms
1(4fluoro3methylphenyl)2((4hydroxy5678tetrahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)ethanone
2(2(4fluoro3methylphenyl)2oxoethyl)sulfanyl5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CC1=C(C=CC(=C1)C(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)F
InChI=1SC19H17FN2O2S2c110811(6713(10)20)14(23)925192117(24)1612423515(12)2618(16)2219h68H259H21H3(H212224)
MFCD03641871
ZINC000017951692
ZINC17951692
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