Vitas-M small molecule compound
ethyl 2-{[(E)-(2-hydroxy-5-nitrophenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Catalog ID
STK200227
SMILES CCOC(=O)c1c(/N=C/c2cc(ccc2O)[N+](=O)[O-])sc2c1CCN(C2)C
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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 C18H19N3O5S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O5S/c1-3-26-18(23)16-13-6-7-20(2)10-15(13)27-17(16)19-9-11-8-12(21(24)25)4-5-14(11)22/h4-5,8-9,22H,3,6-7,10H2,1-2H3/b19-9+InChIKey
YTMDEIBVXUMKNK-DJKKODMXSA-NSynonyms
371134-92-8(E)ethyl2((2hydroxy5nitrobenzylidene)amino)6methyl4567tetrahydrothieno(23c)pyridine3carboxylate
2((E)(3ethoxycarbonyl6methyl4567tetrahydrothieno(23c)pyridin6ium2yl)iminomethyl)4nitrophenolate
371134928
CCOC(=O)C1=C(SC2=C1CC(NH+)(C2)C)N=CC3=C(C=CC(=C3)(N+)(=O)(O))(O)
CCOC(=O)c1c(N=Cc2cc(ccc2O)(N+)(=O)(O))sc2c1CCN(C2)C
ethyl2(((E)(2hydroxy5nitrophenyl)methylidene)amino)6methyl4567tetrahydrothieno(23c)pyridine3carboxylate
InChI=1SC18H19N3O5Sc132618(23)16136720(2)1015(13)2717(16)19911812(21(24)25)4514(11)22h458922H36710H212H3b199+
MFCD01147327
ZINC000002314476
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