4-chloranyl-N-[3-phenyl-4-(pyridin-2-ylamino)butyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-phenyl-4-(pyridin-2-ylamino)butyl]benzenesulfonamide Openeye Name: 4-chloro-N-[3-phenyl-4-(2-pyridylamino)butyl]benzenesulfonamide CAS Name: 4-chloro-N-[3-phenyl-4-(2-pyridinylamino)butyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[3-phenyl-4-(pyridin-2-ylamino)butyl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-phenyl-4-(2-pyridylamino)butyl]benzenesulfonamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNS(=O)(=O)C2=CC=C(C=C2)Cl)CNC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(CCNS(=O)(=O)C2=CC=C(C=C2)Cl)CNC3=CC=CC=N3

InChI

InChI=1S/C21H22ClN3O2S/c22-19-9-11-20(12-10-19)28(26,27)25-15-13-18(17-6-2-1-3-7-17)16-24-21-8-4-5-14-23-21/h1-12,14,18,25H,13,15-16H2,(H,23,24)