Vitas-M small molecule compound

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

Catalog ID
STK990811
SMILES CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1cccc(c1)OC

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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 C25H28N6O2 MW 444.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O2/c1-3-4-5-8-14-27-25(32)21-22-24(30-20-13-7-6-12-19(20)29-22)31(23(21)26)28-16-17-10-9-11-18(15-17)33-2/h6-7,9-13,15-16H,3-5,8,14,26H2,1-2H3,(H,27,32)/b28-16+
InChIKey
PTYFBMJHPIISAH-LQKURTRISA-N
Synonyms
836626-57-4
(E)2aminoNhexyl1((3methoxybenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNhexyl1(((E)(3methoxyphenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNhexyl1((E)(3methoxyphenyl)methylideneamino)pyrrolo(32b)quinoxaline3carboxamide
836626574
CCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC(=CC=C4)OC)N
CCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1cccc(c1)OC
InChI=1SC25H28N6O2c13458142725(32)212224(302013761219(20)2922)31(23(21)26)2816171091118(1517)332h679131516H3581426H212H3(H2732)b2816+
MFCD03688316
ZINC000008836227
ZINC102983539

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Available files

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