Vitas-M small molecule compound
2-[(E)-{2-[(3-chlorophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-nitrobenzenesulfonate
Catalog ID
STK378594
SMILES Clc1cccc(c1)C(=O)N/N=C/c1ccccc1OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
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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 C20H14ClN3O6S MW 459.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClN3O6S/c21-16-6-3-5-14(12-16)20(25)23-22-13-15-4-1-2-7-19(15)30-31(28,29)18-10-8-17(9-11-18)24(26)27/h1-13H,(H,23,25)/b22-13+InChIKey
KBSISOVIQMWMBU-LPYMAVHISA-NSynonyms
(2((E)((3chlorobenzoyl)hydrazinylidene)methyl)phenyl)4nitrobenzenesulfonate
2((1E)2((3CHLOROPHENYL)CARBONYLAMINO)2AZAVINYL)PHENYL4NITROBENZENESULFONATE
2((E)(2((3chlorophenyl)carbonyl)hydrazinylidene)methyl)phenyl4nitrobenzenesulfonate
C1=CC=C(C(=C1)C=NNC(=O)C2=CC(=CC=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)(N+)(=O)(O)
Clc1cccc(c1)C(=O)NN=Cc1ccccc1OS(=O)(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H14ClN3O6Sc211663514(1216)20(25)23221315412719(15)3031(2829)1810817(91118)24(26)27h113H(H2325)b2213+
MFCD01874098
ZINC000016157503
ZINC33524485
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