Vitas-M small molecule compound
methyl 3-({4-chloro-5-[(E)-{2-[(4-methoxyphenyl)carbonyl]hydrazinylidene}methyl]-2-oxo-1,3-thiazol-3(2H)-yl}methyl)benzoate
Catalog ID
STK999781
SMILES COc1ccc(cc1)C(=O)N/N=C/c1sc(=O)n(c1Cl)Cc1cccc(c1)C(=O)OC
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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 C21H18ClN3O5S MW 459.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O5S/c1-29-16-8-6-14(7-9-16)19(26)24-23-11-17-18(22)25(21(28)31-17)12-13-4-3-5-15(10-13)20(27)30-2/h3-11H,12H2,1-2H3,(H,24,26)/b23-11+InChIKey
QBOZRYDHFGMWRW-FOKLQQMPSA-NSynonyms
609790-51-4(E)methyl3((4chloro5((2(4methoxybenzoyl)hydrazono)methyl)2oxothiazol3(2H)yl)methyl)benzoate
609790514
COC1=CC=C(C=C1)C(=O)NN=CC2=C(N(C(=O)S2)CC3=CC=CC(=C3)C(=O)OC)Cl
COc1ccc(cc1)C(=O)NN=Cc1sc(=O)n(c1Cl)Cc1cccc(c1)C(=O)OC
InChI=1SC21H18ClN3O5Sc129168614(7916)19(26)2423111718(22)25(21(28)3117)121343515(1013)20(27)302h311H12H212H3(H2426)b2311+
METHYL3((4CHLORO5((E)((4METHOXYBENZOYL)HYDRAZINYLIDENE)METHYL)2OXO13THIAZOL3YL)METHYL)BENZOATE
methyl3((4chloro5((E)(2((4methoxyphenyl)carbonyl)hydrazinylidene)methyl)2oxo13thiazol3(2H)yl)methyl)benzoate
MFCD03678182
ZINC000002222906
ZINC33350874
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