Vitas-M small molecule compound

[(4-chlorophenyl)sulfonyl]{3-[4-(3-phenylpropyl)pyridinium-1-yl]quinoxalin-2-yl}azanide

Catalog ID
STK544874
SMILES Clc1ccc(cc1)S(=O)(=O)[N-]c1nc2ccccc2nc1[n+]1ccc(cc1)CCCc1ccccc1

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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 C28H23ClN4O2S MW 515.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN4O2S/c29-23-13-15-24(16-14-23)36(34,35)32-27-28(31-26-12-5-4-11-25(26)30-27)33-19-17-22(18-20-33)10-6-9-21-7-2-1-3-8-21/h1-5,7-8,11-20H,6,9-10H2
InChIKey
PRBKWWBZKYVRHG-UHFFFAOYSA-N
Synonyms
1262134-03-1
((4chlorophenyl)sulfonyl)(3(4(3phenylpropyl)pyridin1ium1yl)quinoxalin2yl)amide
((4chlorophenyl)sulfonyl)(3(4(3phenylpropyl)pyridinium1yl)quinoxalin2yl)azanide
(4CHLOROPHENYL)SULFONYL(3(4(3PHENYLPROPYL)PYRIDIN1IUM1YL)QUINOXALIN2YL)AZANIDE
1262134031
C1=CC=C(C=C1)CCCC2=CC=(N+)(C=C2)C3=NC4=CC=CC=C4N=C3(N)S(=O)(=O)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)S(=O)(=O)(N)c1nc2ccccc2nc1(n+)1ccc(cc1)CCCc1ccccc1
InChI=1SC28H23ClN4O2Sc2923131524(161423)36(3435)322728(312612541125(26)3027)33191722(182033)1069217213821h15781120H6910H2
MFCD03294066
ZINC000334157367

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Available files

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