4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-(quinolin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-(quinolin-3-ylmethyl)benzenesulfonamide Openeye Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-(3-quinolylmethyl)benzenesulfonamide CAS Name: 4-chloro-N-(2-oxo-3-azepanyl)-N-(3-quinolinylmethyl)benzenesulfonamide IUPAC Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-(quinolin-3-ylmethyl)benzenesulfonamide Traditional Name: 4-chloro-N-(2-ketoazepan-3-yl)-N-(3-quinolylmethyl)benzenesulfonamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC3=CC=CC=C3N=C2)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CC3=CC=CC=C3N=C2)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O3S/c23-18-8-10-19(11-9-18)30(28,29)26(21-7-3-4-12-24-22(21)27)15-16-13-17-5-1-2-6-20(17)25-14-16/h1-2,5-6,8-11,13-14,21H,3-4,7,12,15H2,(H,24,27)