Vitas-M small molecule compound
ethyl 2-{[(E)-{5-bromo-2-[(phenylcarbonyl)oxy]phenyl}methylidene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK536432
SMILES CCOC(=O)c1c(/N=C/c2cc(Br)ccc2OC(=O)c2ccccc2)sc2c1CCC2
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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 C24H20BrNO4S MW 498.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrNO4S/c1-2-29-24(28)21-18-9-6-10-20(18)31-22(21)26-14-16-13-17(25)11-12-19(16)30-23(27)15-7-4-3-5-8-15/h3-5,7-8,11-14H,2,6,9-10H2,1H3/b26-14+InChIKey
WTPJOWQYVBLJCJ-VULFUBBASA-NSynonyms
(E)ethyl2((2(benzoyloxy)5bromobenzylidene)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
CCOC(=O)C1=C(SC2=C1CCC2)N=CC3=C(C=CC(=C3)Br)OC(=O)C4=CC=CC=C4
CCOC(=O)c1c(N=Cc2cc(Br)ccc2OC(=O)c2ccccc2)sc2c1CCC2
ethyl2(((E)(5bromo2((phenylcarbonyl)oxy)phenyl)methylidene)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ethyl2((E)(2benzoyloxy5bromophenyl)methylideneamino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC24H20BrNO4Sc122924(28)2118961020(18)3122(21)2614161317(25)111219(16)3023(27)157435815h35781114H26910H21H3b2614+
MFCD01959734
ZINC000002289226
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