Vitas-M small molecule compound
ethyl 4-(2,4-dimethylphenyl)-2-{[(E)-(2-hydroxy-3-nitro-6,7,8,9-tetrahydrodibenzo[b,d]furan-1-yl)methylidene]amino}thiophene-3-carboxylate
Catalog ID
STK536132
SMILES CCOC(=O)c1c(/N=C/c2c3c(oc4c3CCCC4)cc(c2O)[N+](=O)[O-])scc1c1ccc(cc1C)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 C28H26N2O6S MW 518.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O6S/c1-4-35-28(32)25-20(17-10-9-15(2)11-16(17)3)14-37-27(25)29-13-19-24-18-7-5-6-8-22(18)36-23(24)12-21(26(19)31)30(33)34/h9-14,31H,4-8H2,1-3H3/b29-13+InChIKey
PGJRQXFPIYUYJS-VFLNYLIXSA-NSynonyms
372494-44-5(E)ethyl4(24dimethylphenyl)2(((2hydroxy3nitro6789tetrahydrodibenzo(bd)furan1yl)methylene)amino)thiophene3carboxylate
372494445
CCOC(=O)c1c(N=Cc2c3c(oc4c3CCCC4)cc(c2O)(N+)(=O)(O))scc1c1ccc(cc1C)C
ethyl4(24dimethylphenyl)2(((E)(2hydroxy3nitro6789tetrahydrodibenzo(bd)furan1yl)methylidene)amino)thiophene3carboxylate
MFCD01942684
ZINC000001770440
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