Vitas-M small molecule compound
methyl (2Z)-2-[2,4-bis(acetyloxy)benzylidene]-5-(4-chlorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK702984
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C/c1ccc(cc1OC(=O)C)OC(=O)C)/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 C26H21ClN2O7S MW 540.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN2O7S/c1-13-22(25(33)34-4)23(16-5-8-18(27)9-6-16)29-24(32)21(37-26(29)28-13)11-17-7-10-19(35-14(2)30)12-20(17)36-15(3)31/h5-12,23H,1-4H3/b21-11-InChIKey
LELQLBCFQCBZKB-NHDPSOOVSA-NSynonyms
374095-50-8(Z)4((5(4chlorophenyl)6(methoxycarbonyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidin2ylidene)methyl)13phenylenediacetate
374095508
CC1=C(C(N2C(=O)C(=CC3=C(C=C(C=C3)OC(=O)C)OC(=O)C)SC2=N1)C4=CC=C(C=C4)Cl)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(cc1OC(=O)C)OC(=O)C)s2
InChI=1SC26H21ClN2O7Sc11322(25(33)344)23(165818(27)9616)2924(32)21(3726(29)2813)111771019(3514(2)30)1220(17)3615(3)31h51223H14H3b2111
methyl(2Z)2(24bis(acetyloxy)benzylidene)5(4chlorophenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)5(4CHLOROPHENYL)2((24DIACETYLOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD01951695
ZINC000000633295
ZINC000000633297
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Check stock on Vitas-MAvailable files
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