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

Systemtic Name: N-[4-(1,4-diazepan-1-yl)-2-(phenylsulfonylamino)phenyl]naphthalene-2-sulfonamide hydrochloride Openeye Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]naphthalene-2-sulfonamide hydrochloride CAS Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-2-naphthalenesulfonamide hydrochloride IUPAC Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]naphthalene-2-sulfonamide hydrochloride Traditional Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]naphthalene-2-sulfonamide hydrochloride Formula: C27H29ClN4O4S2 MolecularWeight: 573.12656

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)NS(=O)(=O)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CNCCN(C1)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)NS(=O)(=O)C5=CC=CC=C5.Cl

InChI

InChI=1S/C27H28N4O4S2.ClH/c32-36(33,24-9-2-1-3-10-24)30-27-20-23(31-17-6-15-28-16-18-31)12-14-26(27)29-37(34,35)25-13-11-21-7-4-5-8-22(21)19-25;/h1-5,7-14,19-20,28-30H,6,15-18H2;1H