Vitas-M small molecule compound

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

Catalog ID
STK714516
SMILES CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1cccc(c1)[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 C24H25N7O3 MW 459.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N7O3/c1-2-3-4-7-13-26-24(32)20-21-23(29-19-12-6-5-11-18(19)28-21)30(22(20)25)27-15-16-9-8-10-17(14-16)31(33)34/h5-6,8-12,14-15H,2-4,7,13,25H2,1H3,(H,26,32)/b27-15+
InChIKey
QBNZEASUFHROCM-JFLMPSFJSA-N
Synonyms
840458-83-5
(E)2aminoNhexyl1((3nitrobenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNhexyl1(((E)(3nitrophenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINONHEXYL1((E)(3NITROPHENYL)METHYLIDENEAMINO)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
840458835
CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC(=CC=C4)(N+)(=O)(O))N
CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC24H25N7O3c12347132624(32)202123(291912651118(19)2821)30(22(20)25)271516981017(1416)31(33)34h568121415H2471325H21H3(H2632)b2715+
MFCD03694702
ZINC000002257214
ZINC33351743

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Available files

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