2-azanyl-4-[3-oxidanylidene-3-[6-(phenylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]propyl]benzenecarboximidamide hydrochloride

Systemtic Name: 2-azanyl-4-[3-oxidanylidene-3-[6-(phenylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]propyl]benzenecarboximidamide hydrochloride Openeye Name: 2-amino-4-[3-[6-(benzenesulfonamido)-3,4-dihydro-2H-quinolin-1-yl]-3-oxo-propyl]benzamidine hydrochloride CAS Name: 2-amino-4-[3-[6-(benzenesulfonamido)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]benzenecarboximidamide hydrochloride IUPAC Name: 2-amino-4-[3-[6-(benzenesulfonamido)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]benzenecarboximidamide hydrochloride Traditional Name: 2-amino-4-[3-[6-(benzenesulfonamido)-3,4-dihydro-2H-quinolin-1-yl]-3-keto-propyl]benzamidine hydrochloride Formula: C25H28ClN5O3S MolecularWeight: 514.03952

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)CCC4=CC(=C(C=C4)C(=N)N)N.Cl

Isomeric SMILES

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)CCC4=CC(=C(C=C4)C(=N)N)N.Cl

InChI

InChI=1S/C25H27N5O3S.ClH/c26-22-15-17(8-11-21(22)25(27)28)9-13-24(31)30-14-4-5-18-16-19(10-12-23(18)30)29-34(32,33)20-6-2-1-3-7-20;/h1-3,6-8,10-12,15-16,29H,4-5,9,13-14,26H2,(H3,27,28);1H