Vitas-M small molecule compound
(2E)-N-(1-benzyl-3-cyano-1H-pyrrolo[2,3-b]quinoxalin-2-yl)-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STL327624
SMILES N#Cc1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])n(c2c1nc1ccccc1n2)Cc1ccccc1
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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 C27H18N6O3 MW 474.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N6O3/c28-16-21-25-27(30-23-12-5-4-11-22(23)29-25)32(17-19-7-2-1-3-8-19)26(21)31-24(34)14-13-18-9-6-10-20(15-18)33(35)36/h1-15H,17H2,(H,31,34)/b14-13+InChIKey
KLGUWAYEGFKLQT-BUHFOSPRSA-NSynonyms
373619-25-1(2E)N(1benzyl3cyano1Hpyrrolo(23b)quinoxalin2yl)3(3nitrophenyl)prop2enamide
(E)N(1benzyl3cyano1Hpyrrolo(23b)quinoxalin2yl)3(3nitrophenyl)acrylamide
(E)N(1BENZYL3CYANOPYRROLO(32B)QUINOXALIN2YL)3(3NITROPHENYL)PROP2ENAMIDE
373619251
C1=CC=C(C=C1)CN2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NC(=O)C=CC5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC27H18N6O3c2816212527(302312541122(23)2925)32(17197213819)26(21)3124(34)141318961020(1518)33(35)36h115H17H2(H3134)b1413+
MFCD01949368
N#Cc1c(NC(=O)C=Cc2cccc(c2)(N+)(=O)(O))n(c2c1nc1ccccc1n2)Cc1ccccc1
ZINC000002282050
ZINC02282050
ZINC2282050
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