N-[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[4-[(7-chloro-4-quinolinyl)amino]cyclohexyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]piazthiole-4-sulfonamide Formula: C21H20ClN5O2S2 MolecularWeight: 473.9988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=C3C=CC(=CC3=NC=C2)Cl)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CC(CCC1NC2=C3C=CC(=CC3=NC=C2)Cl)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C21H20ClN5O2S2/c22-13-4-9-16-17(10-11-23-19(16)12-13)24-14-5-7-15(8-6-14)27-31(28,29)20-3-1-2-18-21(20)26-30-25-18/h1-4,9-12,14-15,27H,5-8H2,(H,23,24)