methyl 3-[[(2-fluorophenyl)carbonylamino]methyl]-5-(quinolin-8-ylsulfonylamino)benzoate

Systemtic Name: methyl 3-[[(2-fluorophenyl)carbonylamino]methyl]-5-(quinolin-8-ylsulfonylamino)benzoate Openeye Name: methyl 3-[[(2-fluorobenzoyl)amino]methyl]-5-(8-quinolylsulfonylamino)benzoate CAS Name: 3-[[[(2-fluorophenyl)-oxomethyl]amino]methyl]-5-(8-quinolinylsulfonylamino)benzoic acid methyl ester IUPAC Name: methyl 3-[[(2-fluorobenzoyl)amino]methyl]-5-(quinolin-8-ylsulfonylamino)benzoate Traditional Name: 3-[[(2-fluorobenzoyl)amino]methyl]-5-(8-quinolylsulfonylamino)benzoic acid methyl ester Formula: C25H20FN3O5S MolecularWeight: 493.506803

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=CC3=C2N=CC=C3)CNC(=O)C4=CC=CC=C4F

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=CC3=C2N=CC=C3)CNC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H20FN3O5S/c1-34-25(31)18-12-16(15-28-24(30)20-8-2-3-9-21(20)26)13-19(14-18)29-35(32,33)22-10-4-6-17-7-5-11-27-23(17)22/h2-14,29H,15H2,1H3,(H,28,30)