Vitas-M small molecule compound

N-{(E)-[4-(biphenyl-4-ylethynyl)phenyl]methylidene}-2-chloro-4-nitroaniline

Catalog ID
STK369526
SMILES Clc1cc(ccc1/N=C/c1ccc(cc1)C#Cc1ccc(cc1)c1ccccc1)[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 C27H17ClN2O2 MW 436.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17ClN2O2/c28-26-18-25(30(31)32)16-17-27(26)29-19-22-10-8-20(9-11-22)6-7-21-12-14-24(15-13-21)23-4-2-1-3-5-23/h1-5,8-19H/b29-19+
InChIKey
GKAWLAILRMFUEH-VUTHCHCSSA-N
Synonyms

Clc1cc(ccc1N=Cc1ccc(cc1)C#Cc1ccc(cc1)c1ccccc1)(N+)(=O)(O)
MFCD00331691
N((E)(4(biphenyl4ylethynyl)phenyl)methylidene)2chloro4nitroaniline
ZINC000004017672

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.