2-(5-chloranylthiophen-2-yl)-6-methyl-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-6-methyl-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-6-methyl-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-6-methyl-N-[(4-sulfamoylphenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-6-methyl-N-[(4-sulfamoylphenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-6-methyl-N-(4-sulfamoylbenzyl)cinchoninamide Formula: C22H18ClN3O3S2 MolecularWeight: 471.97962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(S4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(S4)Cl

InChI

InChI=1S/C22H18ClN3O3S2/c1-13-2-7-18-16(10-13)17(11-19(26-18)20-8-9-21(23)30-20)22(27)25-12-14-3-5-15(6-4-14)31(24,28)29/h2-11H,12H2,1H3,(H,25,27)(H2,24,28,29)