2-(3,4-dimethylphenyl)-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[(4-sulfamoylphenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-(4-sulfamoylbenzyl)cinchoninamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)N)C

InChI

InChI=1S/C25H23N3O3S/c1-16-7-10-19(13-17(16)2)24-14-22(21-5-3-4-6-23(21)28-24)25(29)27-15-18-8-11-20(12-9-18)32(26,30)31/h3-14H,15H2,1-2H3,(H,27,29)(H2,26,30,31)