ethyl 2-[[2-[(4-carbamimidoylphenoxy)methyl]-3H-benzimidazol-5-yl]-quinolin-8-ylsulfonyl-amino]ethanoate

Systemtic Name: ethyl 2-[[2-[(4-carbamimidoylphenoxy)methyl]-3H-benzimidazol-5-yl]-quinolin-8-ylsulfonyl-amino]ethanoate Openeye Name: ethyl 2-[[2-[(4-carbamimidoylphenoxy)methyl]-3H-benzimidazol-5-yl]-(8-quinolylsulfonyl)amino]acetate CAS Name: 2-[[2-[(4-carbamimidoylphenoxy)methyl]-3H-benzimidazol-5-yl]-(8-quinolinylsulfonyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(4-carbamimidoylphenoxy)methyl]-3H-benzimidazol-5-yl]-quinolin-8-ylsulfonylamino]acetate Traditional Name: 2-[[2-[(4-amidinophenoxy)methyl]-3H-benzimidazol-5-yl]-(8-quinolylsulfonyl)amino]acetic acid ethyl ester Formula: C28H26N6O5S MolecularWeight: 558.60824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC2=C(C=C1)N=C(N2)COC3=CC=C(C=C3)C(=N)N)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CCOC(=O)CN(C1=CC2=C(C=C1)N=C(N2)COC3=CC=C(C=C3)C(=N)N)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C28H26N6O5S/c1-2-38-26(35)16-34(40(36,37)24-7-3-5-18-6-4-14-31-27(18)24)20-10-13-22-23(15-20)33-25(32-22)17-39-21-11-8-19(9-12-21)28(29)30/h3-15H,2,16-17H2,1H3,(H3,29,30)(H,32,33)