N-[(4-carbamimidoylphenyl)methyl]-6-(phenylsulfonylamino)-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-6-(phenylsulfonylamino)-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride Openeye Name: 6-(benzenesulfonamido)-N-[(4-carbamimidoylphenyl)methyl]-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride CAS Name: 6-(benzenesulfonamido)-N-[(4-carbamimidoylphenyl)methyl]-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride IUPAC Name: 6-(benzenesulfonamido)-N-[(4-carbamimidoylphenyl)methyl]-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-6-(benzenesulfonamido)-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride Formula: C24H26ClN5O3S MolecularWeight: 500.01294

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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)NCC4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)N(C1)C(=O)NCC4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C24H25N5O3S.ClH/c25-23(26)18-10-8-17(9-11-18)16-27-24(30)29-14-4-5-19-15-20(12-13-22(19)29)28-33(31,32)21-6-2-1-3-7-21;/h1-3,6-13,15,28H,4-5,14,16H2,(H3,25,26)(H,27,30);1H