4-(azepan-1-ylsulfonyl)-N-quinolin-8-yl-benzenesulfonamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-quinolin-8-yl-benzenesulfonamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(8-quinolyl)benzenesulfonamide CAS Name: 4-(1-azepanylsulfonyl)-N-(8-quinolinyl)benzenesulfonamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-quinolin-8-ylbenzenesulfonamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(8-quinolyl)benzenesulfonamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H23N3O4S2/c25-29(26,23-20-9-5-7-17-8-6-14-22-21(17)20)18-10-12-19(13-11-18)30(27,28)24-15-3-1-2-4-16-24/h5-14,23H,1-4,15-16H2