Vitas-M small molecule compound
propan-2-yl (2Z)-5-(4-chlorophenyl)-2-(2-hydroxy-3-methoxy-5-nitrobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL508365
SMILES COc1cc(cc(c1O)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)Cl)C(=O)OC(C)C)C)[N+](=O)[O-]
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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 C25H22ClN3O7S MW 543.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O7S/c1-12(2)36-24(32)20-13(3)27-25-28(21(20)14-5-7-16(26)8-6-14)23(31)19(37-25)10-15-9-17(29(33)34)11-18(35-4)22(15)30/h5-12,21,30H,1-4H3/b19-10-InChIKey
PSCVZNQMFHSWSD-GRSHGNNSSA-NSynonyms
5838227
InChI=1SC25H22ClN3O7Sc112(2)3624(32)2013(3)272528(21(20)145716(26)8614)23(31)19(3725)1015917(29(33)34)1118(354)22(15)30h5122130H14H3b1910
MFCD31614421
propan2yl(2~(Z))5(4chlorophenyl)2((2hydroxy3methoxy5nitrophenyl)methylidene)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
propan2yl(2Z)5(4chlorophenyl)2(2hydroxy3methoxy5nitrobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000106017109
ZINC000106017113
Check stock
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Check stock on Vitas-MAvailable files
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