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

Systemtic Name: methyl 3-[[(2-methylphenyl)carbonylamino]methyl]-5-(quinolin-8-ylsulfonylamino)benzoate Openeye Name: methyl 3-[[(2-methylbenzoyl)amino]methyl]-5-(8-quinolylsulfonylamino)benzoate CAS Name: 3-[[[(2-methylphenyl)-oxomethyl]amino]methyl]-5-(8-quinolinylsulfonylamino)benzoic acid methyl ester IUPAC Name: methyl 3-[[(2-methylbenzoyl)amino]methyl]-5-(quinolin-8-ylsulfonylamino)benzoate Traditional Name: 3-[(o-toluoylamino)methyl]-5-(8-quinolylsulfonylamino)benzoic acid methyl ester Formula: C26H23N3O5S MolecularWeight: 489.54292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC2=CC(=CC(=C2)C(=O)OC)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC2=CC(=CC(=C2)C(=O)OC)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C26H23N3O5S/c1-17-7-3-4-10-22(17)25(30)28-16-18-13-20(26(31)34-2)15-21(14-18)29-35(32,33)23-11-5-8-19-9-6-12-27-24(19)23/h3-15,29H,16H2,1-2H3,(H,28,30)