Vitas-M small molecule compound

3,5-dinitro-N-{2,2,2-trichloro-1-[(4-methoxyphenyl)amino]ethyl}benzamide

Catalog ID
STK701483
SMILES COc1ccc(cc1)NC(C(Cl)(Cl)Cl)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C16H13Cl3N4O6 MW 463.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13Cl3N4O6/c1-29-13-4-2-10(3-5-13)20-15(16(17,18)19)21-14(24)9-6-11(22(25)26)8-12(7-9)23(27)28/h2-8,15,20H,1H3,(H,21,24)
InChIKey
KQQIKWSTWHWFTQ-UHFFFAOYSA-N
Synonyms

35dinitroN(222trichloro1((4methoxyphenyl)amino)ethyl)benzamide
35DINITRON(222TRICHLORO1(4METHOXYANILINO)ETHYL)BENZAMIDE
35DINITRON(222TRICHLORO1(4METHOXYPHENYLAMINO)ETHYL)BENZAMIDE
COC1=CC=C(C=C1)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
COc1ccc(cc1)NC(C(Cl)(Cl)Cl)NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H13Cl3N4O6c129134210(3513)2015(16(1718)19)2114(24)9611(22(25)26)812(79)23(27)28h281520H1H3(H2124)
MFCD00340134
ZINC000002688210
ZINC000002688212

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Available files

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