[(4-carbamimidoylphenyl)amino] 2-[5-ethyl-2-[2-(methylsulfonylamino)ethoxy]phenyl]ethanoate

Systemtic Name: [(4-carbamimidoylphenyl)amino] 2-[5-ethyl-2-[2-(methylsulfonylamino)ethoxy]phenyl]ethanoate Openeye Name: (4-carbamimidoylanilino) 2-[5-ethyl-2-[2-(methanesulfonamido)ethoxy]phenyl]acetate CAS Name: 2-[5-ethyl-2-[2-(methanesulfonamido)ethoxy]phenyl]acetic acid (4-carbamimidoylanilino) ester IUPAC Name: (4-carbamimidoylanilino) 2-[5-ethyl-2-[2-(methanesulfonamido)ethoxy]phenyl]acetate Traditional Name: 2-[5-ethyl-2-[2-(methanesulfonamido)ethoxy]phenyl]acetic acid (4-amidinoanilino) ester Formula: C20H26N4O5S MolecularWeight: 434.50924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCNS(=O)(=O)C)CC(=O)ONC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCNS(=O)(=O)C)CC(=O)ONC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C20H26N4O5S/c1-3-14-4-9-18(28-11-10-23-30(2,26)27)16(12-14)13-19(25)29-24-17-7-5-15(6-8-17)20(21)22/h4-9,12,23-24H,3,10-11,13H2,1-2H3,(H3,21,22)