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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=NC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=NC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

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