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

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-N-methyl-6-(phenylsulfonylamino)-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride Openeye Name: 6-(benzenesulfonamido)-N-[(4-carbamimidoylphenyl)methyl]-N-methyl-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride CAS Name: 6-(benzenesulfonamido)-N-[(4-carbamimidoylphenyl)methyl]-N-methyl-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride IUPAC Name: 6-(benzenesulfonamido)-N-[(4-carbamimidoylphenyl)methyl]-N-methyl-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-6-(benzenesulfonamido)-N-methyl-3,4-dihydro-2H-quinoline-1-carboxamide hydrochloride Formula: C25H28ClN5O3S MolecularWeight: 514.03952

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=N)N)C(=O)N2CCCC3=C2C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=N)N)C(=O)N2CCCC3=C2C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C25H27N5O3S.ClH/c1-29(17-18-9-11-19(12-10-18)24(26)27)25(31)30-15-5-6-20-16-21(13-14-23(20)30)28-34(32,33)22-7-3-2-4-8-22;/h2-4,7-14,16,28H,5-6,15,17H2,1H3,(H3,26,27);1H