N-[(4-carbamimidoylphenyl)methyl]-2-[2-oxidanylidene-6-phenethyl-3-[(phenylmethyl)sulfonylamino]pyridin-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-oxidanylidene-6-phenethyl-3-[(phenylmethyl)sulfonylamino]pyridin-1-yl]ethanamide Openeye Name: 2-[3-(benzylsulfonylamino)-2-oxo-6-phenethyl-1-pyridyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-oxo-6-phenethyl-3-[(phenylmethyl)sulfonylamino]-1-pyridinyl]acetamide IUPAC Name: 2-[3-(benzylsulfonylamino)-2-oxo-6-phenethylpyridin-1-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[3-(benzylsulfonylamino)-2-keto-6-phenethyl-1-pyridyl]acetamide Formula: C30H31N5O4S MolecularWeight: 557.66324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)C(=N)N)NS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=C(C(=O)N2CC(=O)NCC3=CC=C(C=C3)C(=N)N)NS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C30H31N5O4S/c31-29(32)25-14-11-23(12-15-25)19-33-28(36)20-35-26(16-13-22-7-3-1-4-8-22)17-18-27(30(35)37)34-40(38,39)21-24-9-5-2-6-10-24/h1-12,14-15,17-18,34H,13,16,19-21H2,(H3,31,32)(H,33,36)