Vitas-M small molecule compound
6-(2-chlorobenzyl)-3-(4-ethoxyphenyl)-5-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Catalog ID
STK785286
SMILES CCOc1ccc(cc1)n1c(=S)sc2c1nc(C)n(c2=O)Cc1ccccc1Cl
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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 C21H18ClN3O2S2 MW 443.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O2S2/c1-3-27-16-10-8-15(9-11-16)25-19-18(29-21(25)28)20(26)24(13(2)23-19)12-14-6-4-5-7-17(14)22/h4-11H,3,12H2,1-2H3InChIKey
WEJMGICMHHBMGG-UHFFFAOYSA-NSynonyms
6((2CHLOROPHENYL)METHYL)3(4ETHOXYPHENYL)5METHYL2SULFANYLIDENE(13)THIAZOLO(45D)PYRIMIDIN7ONE
6((2CHLOROPHENYL)METHYL)3(4ETHOXYPHENYL)5METHYL2THIOXO6HYDRO13THIAZOLINO(45D)PYRIMIDIN7ONE
6(2chlorobenzyl)3(4ethoxyphenyl)5methyl2thioxo23dihydro(13)thiazolo(45d)pyrimidin7(6H)one
CCOC1=CC=C(C=C1)N2C3=C(C(=O)N(C(=N3)C)CC4=CC=CC=C4Cl)SC2=S
InChI=1SC21H18ClN3O2S2c13271610815(91116)251918(2921(25)28)20(26)24(13(2)2319)1214645717(14)22h411H312H212H3
MFCD07658012
ZINC000012411999
ZINC12411999
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