Vitas-M small molecule compound
(3Z)-3-(2-nitrobenzylidene)-2,3-dihydropyrrolo[1,2-a]quinazolin-5(1H)-one
Catalog ID
STK716039
SMILES O=c1nc2/C(=C\c3ccccc3[N+](=O)[O-])/CCn2c2c1cccc2
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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 C18H13N3O3 MW 319.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O3/c22-18-14-6-2-4-8-16(14)20-10-9-13(17(20)19-18)11-12-5-1-3-7-15(12)21(23)24/h1-8,11H,9-10H2/b13-11-InChIKey
XVJLUFRRDJLDEC-QBFSEMIESA-NSynonyms
(3Z)3((2nitrophenyl)methylidene)12dihydropyrrolo(12a)quinazolin5one
(3Z)3(2nitrobenzylidene)23dihydropyrrolo(12a)quinazolin5(1H)one
(E)3(2nitrobenzylidene)23dihydropyrrolo(12a)quinazolin5(1H)one
C1CN2C3=CC=CC=C3C(=O)N=C2C1=CC4=CC=CC=C4(N+)(=O)(O)
InChI=1SC18H13N3O3c221814624816(14)2010913(17(20)1918)1112513715(12)21(23)24h1811H910H2b1311
MFCD08166917
O=c1nc2C(=Cc3ccccc3(N+)(=O)(O))CCn2c2c1cccc2
ZINC000011692053
ZINC11692053
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