2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(methylsulfonylamino)benzoic acid

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(methylsulfonylamino)benzoic acid Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(methanesulfonamido)benzoic acid CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-5-(methanesulfonamido)benzoic acid IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(methanesulfonamido)benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]-5-(methanesulfonamido)benzoic acid Formula: C22H20N4O5S MolecularWeight: 452.483

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)O

InChI

InChI=1S/C22H20N4O5S/c1-32(30,31)26-15-10-11-17(19(12-15)22(28)29)16-4-2-3-5-18(16)21(27)25-14-8-6-13(7-9-14)20(23)24/h2-12,26H,1H3,(H3,23,24)(H,25,27)(H,28,29)