Vitas-M small molecule compound
2-[(E)-{[3-(4-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl]-4,6-dinitrophenol
Catalog ID
STK508977
SMILES Cc1ccc(cc1)c1nnc(n1/N=C/c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-])S
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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 C16H12N6O5S MW 400.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N6O5S/c1-9-2-4-10(5-3-9)15-18-19-16(28)20(15)17-8-11-6-12(21(24)25)7-13(14(11)23)22(26)27/h2-8,23H,1H3,(H,19,28)/b17-8+InChIKey
JTTZIEZGLZVQHS-CAOOACKPSA-NSynonyms
2((E)((3(4methylphenyl)5sulfanyl4H124triazol4yl)imino)methyl)46dinitrophenol
Cc1ccc(cc1)c1nnc(n1N=Cc1cc(cc(c1O)(N+)(=O)(O))(N+)(=O)(O))S
MFCD01020022
ZINC000015016566
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