2-[4-[(4-carbamimidoylphenoxy)methyl]-2-(quinolin-8-ylsulfonylamino)benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(4-carbamimidoylphenoxy)methyl]-2-(quinolin-8-ylsulfonylamino)benzimidazol-1-yl]ethanoic acid Openeye Name: 2-[4-[(4-carbamimidoylphenoxy)methyl]-2-(8-quinolylsulfonylamino)benzimidazol-1-yl]acetic acid CAS Name: 2-[4-[(4-carbamimidoylphenoxy)methyl]-2-(8-quinolinylsulfonylamino)-1-benzimidazolyl]acetic acid IUPAC Name: 2-[4-[(4-carbamimidoylphenoxy)methyl]-2-(quinolin-8-ylsulfonylamino)benzimidazol-1-yl]acetic acid Traditional Name: 2-[4-[(4-amidinophenoxy)methyl]-2-(8-quinolylsulfonylamino)benzimidazol-1-yl]acetic acid Formula: C26H22N6O5S MolecularWeight: 530.55508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)NC3=NC4=C(C=CC=C4N3CC(=O)O)COC5=CC=C(C=C5)C(=N)N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)NC3=NC4=C(C=CC=C4N3CC(=O)O)COC5=CC=C(C=C5)C(=N)N)N=CC=C2

InChI

InChI=1S/C26H22N6O5S/c27-25(28)17-9-11-19(12-10-17)37-15-18-5-1-7-20-23(18)30-26(32(20)14-22(33)34)31-38(35,36)21-8-2-4-16-6-3-13-29-24(16)21/h1-13H,14-15H2,(H3,27,28)(H,30,31)(H,33,34)