2-(methylsulfonylamino)-2-[4-[3-(pyridin-3-ylmethylcarbamoylamino)phenyl]phenyl]propanoic acid

Systemtic Name: 2-(methylsulfonylamino)-2-[4-[3-(pyridin-3-ylmethylcarbamoylamino)phenyl]phenyl]propanoic acid Openeye Name: 2-(methanesulfonamido)-2-[4-[3-(3-pyridylmethylcarbamoylamino)phenyl]phenyl]propanoic acid CAS Name: 2-(methanesulfonamido)-2-[4-[3-[[oxo-(3-pyridinylmethylamino)methyl]amino]phenyl]phenyl]propanoic acid IUPAC Name: 2-(methanesulfonamido)-2-[4-[3-(pyridin-3-ylmethylcarbamoylamino)phenyl]phenyl]propanoic acid Traditional Name: 2-(methanesulfonamido)-2-[4-[3-(3-pyridylmethylcarbamoylamino)phenyl]phenyl]propionic acid Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)NCC3=CN=CC=C3)(C(=O)O)NS(=O)(=O)C

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)NCC3=CN=CC=C3)(C(=O)O)NS(=O)(=O)C

InChI

InChI=1S/C23H24N4O5S/c1-23(21(28)29,27-33(2,31)32)19-10-8-17(9-11-19)18-6-3-7-20(13-18)26-22(30)25-15-16-5-4-12-24-14-16/h3-14,27H,15H2,1-2H3,(H,28,29)(H2,25,26,30)