Vitas-M small molecule compound
methyl (2E)-5-(4-tert-butylphenyl)-2-(4-chlorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK794256
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)(C)C)c(=O)/c(=C\c1ccc(cc1)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 C26H25ClN2O3S MW 481.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O3S/c1-15-21(24(31)32-5)22(17-8-10-18(11-9-17)26(2,3)4)29-23(30)20(33-25(29)28-15)14-16-6-12-19(27)13-7-16/h6-14,22H,1-5H3/b20-14+InChIKey
MNULFOFXZMLJKP-XSFVSMFZSA-NSynonyms
372494-52-5(E)methyl5(4(tertbutyl)phenyl)2(4chlorobenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
372494525
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)Cl)SC2=N1)C4=CC=C(C=C4)C(C)(C)C)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)(C)C)c(=O)c(=Cc1ccc(cc1)Cl)s2
InChI=1SC26H25ClN2O3Sc11521(24(31)325)22(1781018(11917)26(23)4)2923(30)20(3325(29)2815)141661219(27)13716h61422H15H3b2014+
methyl(2E)5(4tertbutylphenyl)2((4chlorophenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4tertbutylphenyl)2(4chlorobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL5(4TERTBUTYLPHENYL)2((4CHLOROPHENYL)METHYLIDENE)7METHYL3OXO2H3H5HPYRIMIDO(21B)(13)THIAZOLE6CARBOXYLATE
MFCD01942704
ZINC000013765299
ZINC000013765302
Check stock
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Check stock on Vitas-MAvailable files
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