2-(4-chlorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-[(5-sulfamoyl-2-thienyl)methyl]quinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[(5-sulfamoyl-2-thiophenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-[(5-sulfamoylthiophen-2-yl)methyl]quinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-[(5-sulfamoyl-2-thienyl)methyl]cinchoninamide Formula: C21H16ClN3O3S2 MolecularWeight: 457.95304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)NCC4=CC=C(S4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)NCC4=CC=C(S4)S(=O)(=O)N

InChI

InChI=1S/C21H16ClN3O3S2/c22-14-7-5-13(6-8-14)19-11-17(16-3-1-2-4-18(16)25-19)21(26)24-12-15-9-10-20(29-15)30(23,27)28/h1-11H,12H2,(H,24,26)(H2,23,27,28)