2-[3-[1-(6-carbamimidoyl-1H-benzimidazol-2-yl)-4-methyl-pentyl]-2-oxidanylidene-benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[1-(6-carbamimidoyl-1H-benzimidazol-2-yl)-4-methyl-pentyl]-2-oxidanylidene-benzimidazol-1-yl]ethanoic acid Openeye Name: 2-[3-[1-(6-carbamimidoyl-1H-benzimidazol-2-yl)-4-methyl-pentyl]-2-oxo-benzimidazol-1-yl]acetic acid CAS Name: 2-[3-[1-(6-carbamimidoyl-1H-benzimidazol-2-yl)-4-methylpentyl]-2-oxo-1-benzimidazolyl]acetic acid IUPAC Name: 2-[3-[1-(6-carbamimidoyl-1H-benzimidazol-2-yl)-4-methylpentyl]-2-oxobenzimidazol-1-yl]acetic acid Traditional Name: 2-[3-[1-(6-amidino-1H-benzimidazol-2-yl)-4-methyl-pentyl]-2-keto-benzimidazol-1-yl]acetic acid Formula: C23H26N6O3 MolecularWeight: 434.49094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C1=NC2=C(N1)C=C(C=C2)C(=N)N)N3C4=CC=CC=C4N(C3=O)CC(=O)O

Isomeric SMILES

CC(C)CCC(C1=NC2=C(N1)C=C(C=C2)C(=N)N)N3C4=CC=CC=C4N(C3=O)CC(=O)O

InChI

InChI=1S/C23H26N6O3/c1-13(2)7-10-19(22-26-15-9-8-14(21(24)25)11-16(15)27-22)29-18-6-4-3-5-17(18)28(23(29)32)12-20(30)31/h3-6,8-9,11,13,19H,7,10,12H2,1-2H3,(H3,24,25)(H,26,27)(H,30,31)