N-[(4-carbamimidoylphenyl)methyl]-2-[3-oxidanylidene-4-(phenylsulfonylamino)morpholin-2-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-oxidanylidene-4-(phenylsulfonylamino)morpholin-2-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonamido)-3-oxo-morpholin-2-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide CAS Name: 2-[4-(benzenesulfonamido)-3-oxo-2-morpholinyl]-N-[(4-carbamimidoylphenyl)methyl]acetamide IUPAC Name: 2-[4-(benzenesulfonamido)-3-oxomorpholin-2-yl]-N-[(4-carbamimidoylphenyl)methyl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[4-(benzenesulfonamido)-3-keto-morpholin-2-yl]acetamide Formula: C20H23N5O5S MolecularWeight: 445.49212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC(C(=O)N1NS(=O)(=O)C2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1COC(C(=O)N1NS(=O)(=O)C2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H23N5O5S/c21-19(22)15-8-6-14(7-9-15)13-23-18(26)12-17-20(27)25(10-11-30-17)24-31(28,29)16-4-2-1-3-5-16/h1-9,17,24H,10-13H2,(H3,21,22)(H,23,26)