Vitas-M small molecule compound

ethyl (2Z)-5-(4-chlorophenyl)-2-(4-hydroxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL296341
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C/c1ccc(cc1)O)/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 C23H19ClN2O4S MW 454.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN2O4S/c1-3-30-22(29)19-13(2)25-23-26(20(19)15-6-8-16(24)9-7-15)21(28)18(31-23)12-14-4-10-17(27)11-5-14/h4-12,20,27H,3H2,1-2H3/b18-12-
InChIKey
WPVUJHCNRJPVHH-PDGQHHTCSA-N
Synonyms

(Z)ethyl5(4chlorophenyl)2(4hydroxybenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(cc1)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC=C(C=C4)O)S2)C
ETHYL(2Z)5(4CHLOROPHENYL)2((4HYDROXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(4chlorophenyl)2(4hydroxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL5(4CHLOROPHENYL)2((4HYDROXYPHENYL)METHYLENE)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC23H19ClN2O4Sc133022(29)1913(2)252326(20(19)156816(24)9715)21(28)18(3123)121441017(27)11514h4122027H3H212H3b1812
MFCD01053355
ZINC000000759398
ZINC000000759400

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.