4-[2-[(4-carbamimidoylphenyl)methyl]-5-(2-dimethylaminoethylsulfamoyl)benzimidazol-1-yl]butanoic acid

Systemtic Name: 4-[2-[(4-carbamimidoylphenyl)methyl]-5-(2-dimethylaminoethylsulfamoyl)benzimidazol-1-yl]butanoic acid Openeye Name: 4-[2-[(4-carbamimidoylphenyl)methyl]-5-(2-dimethylaminoethylsulfamoyl)benzimidazol-1-yl]butanoic acid CAS Name: 4-[2-[(4-carbamimidoylphenyl)methyl]-5-(2-dimethylaminoethylsulfamoyl)-1-benzimidazolyl]butanoic acid IUPAC Name: 4-[2-[(4-carbamimidoylphenyl)methyl]-5-(2-dimethylaminoethylsulfamoyl)benzimidazol-1-yl]butanoic acid Traditional Name: 4-[2-(4-amidinobenzyl)-5-(2-dimethylaminoethylsulfamoyl)benzimidazol-1-yl]butyric acid Formula: C23H30N6O4S MolecularWeight: 486.5871

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CC3=CC=C(C=C3)C(=N)N)CCCC(=O)O

Isomeric SMILES

CN(C)CCNS(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CC3=CC=C(C=C3)C(=N)N)CCCC(=O)O

InChI

InChI=1S/C23H30N6O4S/c1-28(2)13-11-26-34(32,33)18-9-10-20-19(15-18)27-21(29(20)12-3-4-22(30)31)14-16-5-7-17(8-6-16)23(24)25/h5-10,15,26H,3-4,11-14H2,1-2H3,(H3,24,25)(H,30,31)