Vitas-M small molecule compound
ethyl {[3-(4-chloro-3-methylphenyl)-6-(4-fluorophenyl)-7-oxo-2-thioxo-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetate
Catalog ID
STL145274
SMILES CCOC(=O)CSc1nc2n(c3ccc(c(c3)C)Cl)c(=S)sc2c(=O)n1c1ccc(cc1)F
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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 C22H17ClFN3O3S3 MW 522.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClFN3O3S3/c1-3-30-17(28)11-32-21-25-19-18(20(29)27(21)14-6-4-13(24)5-7-14)33-22(31)26(19)15-8-9-16(23)12(2)10-15/h4-10H,3,11H2,1-2H3InChIKey
SRTNWRKRFCQGMJ-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NC2=C(C(=O)N1C3=CC=C(C=C3)F)SC(=S)N2C4=CC(=C(C=C4)Cl)C
ethyl((3(4chloro3methylphenyl)6(4fluorophenyl)7oxo2thioxo2367tetrahydro(13)thiazolo(45d)pyrimidin5yl)sulfanyl)acetate
ETHYL2((3(4CHLORO3METHYLPHENYL)6(4FLUOROPHENYL)7OXO2SULFANYLIDENE(13)THIAZOLO(45D)PYRIMIDIN5YL)SULFANYL)ACETATE
InChI=1SC22H17ClFN3O3S3c133017(28)113221251918(20(29)27(21)146413(24)5714)3322(31)26(19)158916(23)12(2)1015h410H311H212H3
MFCD15090317
ZINC000003026650
ZINC3026650
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