Vitas-M small molecule compound

2-amino-N-benzyl-1-{[(E)-(3-nitrophenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK714440
SMILES [O-][N+](=O)c1cccc(c1)/C=N/n1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccccc1

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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 C25H19N7O3 MW 465.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N7O3/c26-23-21(25(33)27-14-16-7-2-1-3-8-16)22-24(30-20-12-5-4-11-19(20)29-22)31(23)28-15-17-9-6-10-18(13-17)32(34)35/h1-13,15H,14,26H2,(H,27,33)/b28-15+
InChIKey
DEHATSBCRRYZCB-RWPZCVJISA-N
Synonyms
713129-34-1
(E)2aminoNbenzyl1((3nitrobenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
(O)(N+)(=O)c1cccc(c1)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccccc1
2aminoNbenzyl1(((E)(3nitrophenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINONBENZYL1((E)(3NITROPHENYL)METHYLIDENEAMINO)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
713129341
C1=CC=C(C=C1)CNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC(=CC=C5)(N+)(=O)(O))N
InChI=1SC25H19N7O3c262321(25(33)2714167213816)2224(302012541119(20)2922)31(23)281517961018(1317)32(34)35h11315H1426H2(H2733)b2815+
MFCD03694239
ZINC000001773183
ZINC33343169

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Available files

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