Vitas-M small molecule compound

methyl 2-{[(1-butyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)carbonyl]amino}benzoate

Catalog ID
STK034094
SMILES CCCCn1c(=O)c(C(=O)Nc2ccccc2C(=O)OC)c(c2c1cccc2)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 C22H22N2O5 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5/c1-3-4-13-24-17-12-8-6-10-15(17)19(25)18(21(24)27)20(26)23-16-11-7-5-9-14(16)22(28)29-2/h5-12,25H,3-4,13H2,1-2H3,(H,23,26)
InChIKey
IRXFIVKKCXXRMI-UHFFFAOYSA-N
Synonyms
331829-47-1
331829471
CCCCn1c(=O)c(C(=O)Nc2ccccc2C(=O)OC)c(c2c1cccc2)O
CCCCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NC3=CC=CC=C3C(=O)OC)O
InChI=1SC22H22N2O5c13413241712861015(17)19(25)18(21(24)27)20(26)23161175914(16)22(28)292h51225H3413H212H3(H2326)
METHYL2(((1BUTYL4HYDROXY2OXO12DIHYDROQUINOLIN3YL)CARBONYL)AMINO)BENZOATE
METHYL2((1BUTYL2HYDROXY4OXOQUINOLINE3CARBONYL)AMINO)BENZOATE
methyl2((1butyl4hydroxy2oxoquinoline3carbonyl)amino)benzoate
METHYL2(1BUTYL4HYDROXY2OXO12DIHYDROQUINOLINE3AMIDO)BENZOATE
methyl2(1butyl4hydroxy2oxo12dihydroquinoline3carboxamido)benzoate
MFCD01046258
STK034094
ZINC000100543113
ZINC100543113

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Available files

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