3-(4-carbamimidoylphenyl)-2-[3-(naphthalen-2-ylsulfonylamino)-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid

Systemtic Name: 3-(4-carbamimidoylphenyl)-2-[3-(naphthalen-2-ylsulfonylamino)-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid Openeye Name: 3-(4-carbamimidoylphenyl)-2-[3-(2-naphthylsulfonylamino)-2-oxo-pyrrolidin-1-yl]propanoic acid CAS Name: 3-(4-carbamimidoylphenyl)-2-[3-(2-naphthalenylsulfonylamino)-2-oxo-1-pyrrolidinyl]propanoic acid IUPAC Name: 3-(4-carbamimidoylphenyl)-2-[3-(naphthalen-2-ylsulfonylamino)-2-oxopyrrolidin-1-yl]propanoic acid Traditional Name: 3-(4-amidinophenyl)-2-[2-keto-3-(2-naphthylsulfonylamino)pyrrolidino]propionic acid Formula: C24H24N4O5S MolecularWeight: 480.53616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1NS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(CC4=CC=C(C=C4)C(=N)N)C(=O)O

Isomeric SMILES

C1CN(C(=O)C1NS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(CC4=CC=C(C=C4)C(=N)N)C(=O)O

InChI

InChI=1S/C24H24N4O5S/c25-22(26)17-7-5-15(6-8-17)13-21(24(30)31)28-12-11-20(23(28)29)27-34(32,33)19-10-9-16-3-1-2-4-18(16)14-19/h1-10,14,20-21,27H,11-13H2,(H3,25,26)(H,30,31)