Vitas-M small molecule compound
(2E)-N-(1-butyl-3-cyano-1H-pyrrolo[2,3-b]quinoxalin-2-yl)-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STL334430
SMILES CCCCn1c2nc3ccccc3nc2c(c1NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-])C#N
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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 C24H20N6O3 MW 440.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N6O3/c1-2-3-13-29-23(28-21(31)12-11-16-7-6-8-17(14-16)30(32)33)18(15-25)22-24(29)27-20-10-5-4-9-19(20)26-22/h4-12,14H,2-3,13H2,1H3,(H,28,31)/b12-11+InChIKey
QCTOPSSUQXOHEA-VAWYXSNFSA-NSynonyms
372495-44-8(2E)N(1butyl3cyano1Hpyrrolo(23b)quinoxalin2yl)3(3nitrophenyl)prop2enamide
(E)N(1butyl3cyano1Hpyrrolo(23b)quinoxalin2yl)3(3nitrophenyl)acrylamide
(E)N(1BUTYL3CYANOPYRROLO(32B)QUINOXALIN2YL)3(3NITROPHENYL)PROP2ENAMIDE
372495448
CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C=CC4=CC(=CC=C4)(N+)(=O)(O)
CCCCn1c2nc3ccccc3nc2c(c1NC(=O)C=Cc1cccc(c1)(N+)(=O)(O))C#N
InChI=1SC24H20N6O3c123132923(2821(31)12111676817(1416)30(32)33)18(1525)2224(29)27201054919(20)2622h41214H2313H21H3(H2831)b1211+
MFCD01942871
ZINC000002206366
ZINC02206366
ZINC2206366
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