Vitas-M small molecule compound
ethyl (2Z)-2-(3,5-dichloro-2-hydroxybenzylidene)-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK024562
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1cc(Cl)cc(c1O)Cl)/s2
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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 C21H16Cl2N2O4S2 MW 495.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl2N2O4S2/c1-3-29-20(28)16-10(2)24-21-25(17(16)14-5-4-6-30-14)19(27)15(31-21)8-11-7-12(22)9-13(23)18(11)26/h4-9,17,26H,3H2,1-2H3/b15-8-InChIKey
ZFSSEWGJMYXACM-NVNXTCNLSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1cc(Cl)cc(c1O)Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC(=CC(=C4O)Cl)Cl)S2)C
ethyl(2Z)2((35dichloro2hydroxyphenyl)methylidene)7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(35DICHLORO2HYDROXYBENZYLIDENE)7METHYL3OXO5(THIOPHEN2YL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC21H16Cl2N2O4S2c132920(28)1610(2)242125(17(16)145463014)19(27)15(3121)811712(22)913(23)18(11)26h491726H3H212H3b158
MFCD13368303
STK024562
ZINC000000707521
ZINC000000707523
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