4-[1-methyl-5-(N'-propan-2-ylcarbamimidoyl)benzimidazol-2-yl]benzoic acid

Systemtic Name: 4-[1-methyl-5-(N'-propan-2-ylcarbamimidoyl)benzimidazol-2-yl]benzoic acid Openeye Name: 4-[5-(N'-isopropylcarbamimidoyl)-1-methyl-benzimidazol-2-yl]benzoic acid CAS Name: 4-[5-[amino(propan-2-ylimino)methyl]-1-methyl-2-benzimidazolyl]benzoic acid IUPAC Name: 4-[1-methyl-5-(N'-propan-2-ylcarbamimidoyl)benzimidazol-2-yl]benzoic acid Traditional Name: 4-[5-(N'-isopropylamidino)-1-methyl-benzimidazol-2-yl]benzoic acid Formula: C19H20N4O2 MolecularWeight: 336.3877

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=O)O)C)N

Isomeric SMILES

CC(C)N=C(C1=CC2=C(C=C1)N(C(=N2)C3=CC=C(C=C3)C(=O)O)C)N

InChI

InChI=1S/C19H20N4O2/c1-11(2)21-17(20)14-8-9-16-15(10-14)22-18(23(16)3)12-4-6-13(7-5-12)19(24)25/h4-11H,1-3H3,(H2,20,21)(H,24,25)