N-[(4-carbamimidoylphenyl)methyl]-2-[2-oxidanylidene-3-[(phenylmethyl)sulfonylamino]quinolin-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-oxidanylidene-3-[(phenylmethyl)sulfonylamino]quinolin-1-yl]ethanamide Openeye Name: 2-[3-(benzylsulfonylamino)-2-oxo-1-quinolyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-oxo-3-[(phenylmethyl)sulfonylamino]-1-quinolinyl]acetamide IUPAC Name: 2-[3-(benzylsulfonylamino)-2-oxoquinolin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[3-(benzylsulfonylamino)-2-keto-1-quinolyl]acetamide Formula: C26H25N5O4S MolecularWeight: 503.5728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NC2=CC3=CC=CC=C3N(C2=O)CC(=O)NCC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)NC2=CC3=CC=CC=C3N(C2=O)CC(=O)NCC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C26H25N5O4S/c27-25(28)20-12-10-18(11-13-20)15-29-24(32)16-31-23-9-5-4-8-21(23)14-22(26(31)33)30-36(34,35)17-19-6-2-1-3-7-19/h1-14,30H,15-17H2,(H3,27,28)(H,29,32)