Vitas-M small molecule compound
ethyl 4-{[(2E)-2-{[3-(4-bromobenzyl)-4-chloro-2-oxo-2,3-dihydro-1,3-thiazol-5-yl]methylidene}hydrazinyl]carbonyl}benzoate
Catalog ID
STL010722
SMILES CCOC(=O)c1ccc(cc1)C(=O)N/N=C/c1sc(=O)n(c1Cl)Cc1ccc(cc1)Br
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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 C21H17BrClN3O4S MW 522.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrClN3O4S/c1-2-30-20(28)15-7-5-14(6-8-15)19(27)25-24-11-17-18(23)26(21(29)31-17)12-13-3-9-16(22)10-4-13/h3-11H,2,12H2,1H3,(H,25,27)/b24-11+InChIKey
VIJRDFPPAVVPHN-BHGWPJFGSA-NSynonyms
609791-73-3(E)ethyl4(2((3(4bromobenzyl)4chloro2oxo23dihydrothiazol5yl)methylene)hydrazinecarbonyl)benzoate
609791733
CCOC(=O)C1=CC=C(C=C1)C(=O)NN=CC2=C(N(C(=O)S2)CC3=CC=C(C=C3)Br)Cl
CCOC(=O)c1ccc(cc1)C(=O)NN=Cc1sc(=O)n(c1Cl)Cc1ccc(cc1)Br
ethyl4(((2E)2((3(4bromobenzyl)4chloro2oxo23dihydro13thiazol5yl)methylidene)hydrazinyl)carbonyl)benzoate
ETHYL4(((E)(3((4BROMOPHENYL)METHYL)4CHLORO2OXO13THIAZOL5YL)METHYLIDENEAMINO)CARBAMOYL)BENZOATE
InChI=1SC21H17BrClN3O4Sc123020(28)157514(6815)19(27)2524111718(23)26(21(29)3117)12133916(22)10413h311H212H21H3(H2527)b2411+
MFCD03679370
ZINC000002225913
ZINC103678448
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