Vitas-M small molecule compound
ethyl 2-{[(E)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK199877
SMILES CCOC(=O)c1c(/N=C/c2cc(Br)cc(c2O)[N+](=O)[O-])sc2c1CCCC2
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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 C18H17BrN2O5S MW 453.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN2O5S/c1-2-26-18(23)15-12-5-3-4-6-14(12)27-17(15)20-9-10-7-11(19)8-13(16(10)22)21(24)25/h7-9,22H,2-6H2,1H3/b20-9+InChIKey
RSNYVAKDAPKNCJ-AWQFTUOYSA-NSynonyms
CCOC(=O)c1c(N=Cc2cc(Br)cc(c2O)(N+)(=O)(O))sc2c1CCCC2
ethyl2(((E)(5bromo2hydroxy3nitrophenyl)methylidene)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01053071
ZINC000009934772
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