N-[4-(azepan-1-yl)phenyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-4-morpholinosulfonyl-benzenesulfonamide CAS Name: N-[4-(1-azepanyl)phenyl]-4-(4-morpholinylsulfonyl)benzenesulfonamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-4-morpholin-4-ylsulfonylbenzenesulfonamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-4-morpholinosulfonyl-benzenesulfonamide Formula: C22H29N3O5S2 MolecularWeight: 479.61276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H29N3O5S2/c26-31(27,23-19-5-7-20(8-6-19)24-13-3-1-2-4-14-24)21-9-11-22(12-10-21)32(28,29)25-15-17-30-18-16-25/h5-12,23H,1-4,13-18H2