Vitas-M small molecule compound

methyl 4-{[(5-hydroxy-1-oxo-2,3-dihydropyrrolo[1,2-a]quinazolin-3a(1H)-yl)carbonyl]amino}benzoate (non-preferred name)

Catalog ID
STL539159
SMILES COC(=O)c1ccc(cc1)NC(=O)C12CCC(=O)N2c2c(C(=N1)O)cccc2

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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 C20H17N3O5 MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O5/c1-28-18(26)12-6-8-13(9-7-12)21-19(27)20-11-10-16(24)23(20)15-5-3-2-4-14(15)17(25)22-20/h2-9H,10-11H2,1H3,(H,21,27)(H,22,25)
InChIKey
ZHPZBZIFPFAPHY-UHFFFAOYSA-N
Synonyms
1574289-46-5
1574289465
71825770
InChI=1SC20H17N3O5c12818(26)126813(9712)2119(27)20111016(24)23(20)15532414(15)17(25)2220h29H1011H21H3(H2127)(H2225)
methyl4(((5hydroxy1oxo23dihydropyrrolo(12a)quinazolin3a(1H)yl)carbonyl)amino)benzoate(nonpreferredname)
methyl4((15dioxo34dihydro2~(H)pyrrolo(12a)quinazoline3~(a)carbonyl)amino)benzoate
MFCD31754775
ZINC000096116178
ZINC000096116179

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.