N-[4-(1,4-diazepan-1-yl)-2-(phenylsulfonylamino)phenyl]-4-phenyl-benzenesulfonamide hydrochloride

Systemtic Name: N-[4-(1,4-diazepan-1-yl)-2-(phenylsulfonylamino)phenyl]-4-phenyl-benzenesulfonamide hydrochloride Openeye Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-4-phenyl-benzenesulfonamide hydrochloride CAS Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-4-phenylbenzenesulfonamide hydrochloride IUPAC Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-4-phenylbenzenesulfonamide hydrochloride Traditional Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-4-phenyl-benzenesulfonamide hydrochloride Formula: C29H31ClN4O4S2 MolecularWeight: 599.16384

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4)NS(=O)(=O)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CNCCN(C1)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=CC=C4)NS(=O)(=O)C5=CC=CC=C5.Cl

InChI

InChI=1S/C29H30N4O4S2.ClH/c34-38(35,26-10-5-2-6-11-26)32-29-22-25(33-20-7-18-30-19-21-33)14-17-28(29)31-39(36,37)27-15-12-24(13-16-27)23-8-3-1-4-9-23;/h1-6,8-17,22,30-32H,7,18-21H2;1H