2-[4-[(4-carbamimidoylphenyl)sulfamoyl]-3-methanoyl-2-oxidanylidene-4-phenyl-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[4-[(4-carbamimidoylphenyl)sulfamoyl]-3-methanoyl-2-oxidanylidene-4-phenyl-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[4-[(4-carbamimidoylphenyl)sulfamoyl]-3-formyl-2-oxo-4-phenyl-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[4-[(4-carbamimidoylphenyl)sulfamoyl]-3-formyl-2-oxo-4-phenyl-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[4-[(4-carbamimidoylphenyl)sulfamoyl]-3-formyl-2-oxo-4-phenyl-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[4-[(4-amidinophenyl)sulfamoyl]-3-formyl-2-keto-4-phenyl-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C29H30N4O6S MolecularWeight: 562.6367

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)N1CCCC2=CC=CC=C2)(CC(=O)O)C=O)(C3=CC=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1C(C(C(=O)N1CCCC2=CC=CC=C2)(CC(=O)O)C=O)(C3=CC=CC=C3)S(=O)(=O)NC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C29H30N4O6S/c30-26(31)22-13-15-24(16-14-22)32-40(38,39)29(23-11-5-2-6-12-23)19-33(17-7-10-21-8-3-1-4-9-21)27(37)28(29,20-34)18-25(35)36/h1-6,8-9,11-16,20,32H,7,10,17-19H2,(H3,30,31)(H,35,36)