Vitas-M small molecule compound
ethyl (2Z)-5-(2-chlorophenyl)-2-(4-hydroxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL484890
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)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)16-6-4-5-7-17(16)24)21(28)18(31-23)12-14-8-10-15(27)11-9-14/h4-12,20,27H,3H2,1-2H3/b18-12-InChIKey
ISKOTBKWYPWVHF-PDGQHHTCSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)c(=Cc1ccc(cc1)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3Cl)C(=O)C(=CC4=CC=C(C=C4)O)S2)C
ETHYL(2Z)5(2CHLOROPHENYL)2((4HYDROXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(2chlorophenyl)2(4hydroxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(8Z)2(2CHLOROPHENYL)8((4HYDROXYPHENYL)METHYLIDENE)4METHYL9OXO7THIA15DIAZABICYCLO(430)NONA35DIENE3CARBOXYLATE
ETHYL5(2CHLOROPHENYL)2(4HYDROXYBENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC23H19ClN2O4Sc133022(29)1913(2)252326(20(19)16645717(16)24)21(28)18(3123)121481015(27)11914h4122027H3H212H3b1812
MFCD01140525
ZINC000000665000
ZINC000000665003
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