N-[4-(1,4-diazepan-1-yl)-2-(phenylsulfonylamino)phenyl]quinoline-8-sulfonamide hydrochloride

Systemtic Name: N-[4-(1,4-diazepan-1-yl)-2-(phenylsulfonylamino)phenyl]quinoline-8-sulfonamide hydrochloride Openeye Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]quinoline-8-sulfonamide hydrochloride CAS Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]-8-quinolinesulfonamide hydrochloride IUPAC Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]quinoline-8-sulfonamide hydrochloride Traditional Name: N-[2-(benzenesulfonamido)-4-(1,4-diazepan-1-yl)phenyl]quinoline-8-sulfonamide hydrochloride Formula: C26H28ClN5O4S2 MolecularWeight: 574.11462

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)NS(=O)(=O)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CNCCN(C1)C2=CC(=C(C=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)NS(=O)(=O)C5=CC=CC=C5.Cl

InChI

InChI=1S/C26H27N5O4S2.ClH/c32-36(33,22-9-2-1-3-10-22)30-24-19-21(31-17-6-14-27-16-18-31)12-13-23(24)29-37(34,35)25-11-4-7-20-8-5-15-28-26(20)25;/h1-5,7-13,15,19,27,29-30H,6,14,16-18H2;1H