Vitas-M small molecule compound
methyl 3-{[2-(3-nitrophenyl)quinazolin-4-yl]amino}benzoate
Catalog ID
STK839572
SMILES COC(=O)c1cccc(c1)Nc1nc(nc2c1cccc2)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 C22H16N4O4 MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O4/c1-30-22(27)15-7-4-8-16(12-15)23-21-18-10-2-3-11-19(18)24-20(25-21)14-6-5-9-17(13-14)26(28)29/h2-13H,1H3,(H,23,24,25)InChIKey
XXKHVDXGIFWUES-UHFFFAOYSA-NSynonyms
384356-05-2384356052
COC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C4=CC(=CC=C4)(N+)(=O)(O)
COC(=O)c1cccc(c1)Nc1nc(nc2c1cccc2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H16N4O4c13022(27)1574816(1215)23211810231119(18)2420(2521)1465917(1314)26(28)29h213H1H3(H232425)
methyl3((2(3nitrophenyl)quinazolin4yl)amino)benzoate
MFCD03000855
ZINC000001304017
ZINC01304017
ZINC1304017
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