Vitas-M small molecule compound
ethyl (2Z)-2-(3-ethoxy-4-hydroxybenzylidene)-5-(4-ethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL495663
SMILES CCOc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccc(c(c1)OCC)O)/s2)C(=O)OCC
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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 C27H28N2O6S MW 508.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O6S/c1-5-33-19-11-9-18(10-12-19)24-23(26(32)35-7-3)16(4)28-27-29(24)25(31)22(36-27)15-17-8-13-20(30)21(14-17)34-6-2/h8-15,24,30H,5-7H2,1-4H3/b22-15-InChIKey
HBKLYGNPRZTFLX-JCMHNJIXSA-NSynonyms
CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=C(C=C4)O)OCC)S3)C)C(=O)OCC
CCOc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccc(c(c1)OCC)O)s2)C(=O)OCC
ETHYL(2Z)2((3ETHOXY4HYDROXYPHENYL)METHYLIDENE)5(4ETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3ethoxy4hydroxybenzylidene)5(4ethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(3ETHOXY4HYDROXYBENZYLIDENE)5(4ETHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H28N2O6Sc15331911918(101219)2423(26(32)3573)16(4)282729(24)25(31)22(3627)151781320(30)21(1417)3462h8152430H57H214H3b2215
MFCD02070350
ZINC000000665553
ZINC000000665557
Check stock
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Check stock on Vitas-MAvailable files
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