3-[(4-carbamimidoylphenyl)carbamoyl]-2-(furan-2-yl)-5-(2-methylpropylcarbamoyl)benzoic acid

Systemtic Name: 3-[(4-carbamimidoylphenyl)carbamoyl]-2-(furan-2-yl)-5-(2-methylpropylcarbamoyl)benzoic acid Openeye Name: 3-[(4-carbamimidoylphenyl)carbamoyl]-2-(2-furyl)-5-(isobutylcarbamoyl)benzoic acid CAS Name: 3-[(4-carbamimidoylanilino)-oxomethyl]-2-(2-furanyl)-5-[(2-methylpropylamino)-oxomethyl]benzoic acid IUPAC Name: 3-[(4-carbamimidoylphenyl)carbamoyl]-2-(furan-2-yl)-5-(2-methylpropylcarbamoyl)benzoic acid Traditional Name: 3-[(4-amidinophenyl)carbamoyl]-2-(2-furyl)-5-(isobutylcarbamoyl)benzoic acid Formula: C24H24N4O5 MolecularWeight: 448.47116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C(=C1)C(=O)O)C2=CC=CO2)C(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C(=C1)C(=O)O)C2=CC=CO2)C(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C24H24N4O5/c1-13(2)12-27-22(29)15-10-17(20(18(11-15)24(31)32)19-4-3-9-33-19)23(30)28-16-7-5-14(6-8-16)21(25)26/h3-11,13H,12H2,1-2H3,(H3,25,26)(H,27,29)(H,28,30)(H,31,32)