Vitas-M small molecule compound
ethyl 3-(5-{(E)-[2-(4-{[(E)-{5-[3-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene]amino}-4H-1,2,4-triazol-3-yl)hydrazinylidene]methyl}furan-2-yl)benzoate
Catalog ID
STK394263
SMILES CCOC(=O)c1cccc(c1)c1ccc(o1)/C=N/Nc1nncn1/N=C/c1ccc(o1)c1cccc(c1)C(=O)OCC
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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 C30H26N6O6 MW 566.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N6O6/c1-3-39-28(37)22-9-5-7-20(15-22)26-13-11-24(41-26)17-31-34-30-35-32-19-36(30)33-18-25-12-14-27(42-25)21-8-6-10-23(16-21)29(38)40-4-2/h5-19H,3-4H2,1-2H3,(H,34,35)/b31-17+,33-18+InChIKey
IDQPSDXRFBMVID-VWHKTFBESA-NSynonyms
CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=NNC3=NN=CN3N=CC4=CC=C(O4)C5=CC(=CC=C5)C(=O)OCC
CCOC(=O)c1cccc(c1)c1ccc(o1)C=NNc1nncn1N=Cc1ccc(o1)c1cccc(c1)C(=O)OCC
ethyl3(5((E)((4((E)(5(3ethoxycarbonylphenyl)furan2yl)methylideneamino)124triazol3yl)hydrazinylidene)methyl)furan2yl)benzoate
ethyl3(5((E)(2(4(((E)(5(3(ethoxycarbonyl)phenyl)furan2yl)methylidene)amino)4H124triazol3yl)hydrazinylidene)methyl)furan2yl)benzoate
InChI=1SC30H26N6O6c133928(37)2295720(1522)26131124(4126)1731343035321936(30)331825121427(4225)21861023(1621)29(38)4042h519H34H212H3(H3435)b3117+3318+
MFCD07626753
ZINC000097964140
ZINC100210376
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