Vitas-M small molecule compound
benzyl 2,3-dimethoxy-5-oxo-5,6-dihydroquinoxalino[2',3':4,5]pyrrolo[1,2-a]quinazoline-7-carboxylate
Catalog ID
STK991280
SMILES COc1cc2c(cc1OC)c(=O)[nH]c1n2c2nc3ccccc3nc2c1C(=O)OCc1ccccc1
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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 C27H20N4O5 MW 480.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N4O5/c1-34-20-12-16-19(13-21(20)35-2)31-24(30-26(16)32)22(27(33)36-14-15-8-4-3-5-9-15)23-25(31)29-18-11-7-6-10-17(18)28-23/h3-13H,14H2,1-2H3,(H,30,32)InChIKey
LIPBALHASHQIGD-UHFFFAOYSA-NSynonyms
benzyl23dimethoxy5oxo56dihydroquinoxalino(2345)pyrrolo(12a)quinazoline7carboxylate
COC1=C(C=C2C(=C1)C(=O)NC3=C(C4=NC5=CC=CC=C5N=C4N23)C(=O)OCC6=CC=CC=C6)OC
COc1cc2c(cc1OC)c(=O)(nH)c1n2c2nc3ccccc3nc2c1C(=O)OCc1ccccc1
InChI=1SC27H20N4O5c13420121619(1321(20)352)3124(3026(16)32)22(27(33)3614158435915)2325(31)291811761017(18)2823h313H14H212H3(H3032)
MFCD07801874
ZINC000006143819
ZINC6143819
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