Vitas-M small molecule compound
ethyl 2-{[(E)-(2-hydroxy-6-nitronaphthalen-1-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL172674
SMILES CCOC(=O)c1c(/N=C/c2c(O)ccc3c2ccc(c3)[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 C22H20N2O5S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5S/c1-2-29-22(26)20-16-5-3-4-6-19(16)30-21(20)23-12-17-15-9-8-14(24(27)28)11-13(15)7-10-18(17)25/h7-12,25H,2-6H2,1H3/b23-12+InChIKey
ASAPPZACRVLAHE-FSJBWODESA-NSynonyms
330965-57-6330965576
CCOC(=O)c1c(N=Cc2c(O)ccc3c2ccc(c3)(N+)(=O)(O))sc2c1CCCC2
ethyl2(((E)(2hydroxy6nitronaphthalen1yl)methylidene)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD00287536
ZINC000000712354
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