2-[3-[[(5-phenylfuran-2-yl)methyl-pyridin-3-ylsulfonyl-amino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[[(5-phenylfuran-2-yl)methyl-pyridin-3-ylsulfonyl-amino]methyl]phenyl]ethanoic acid Openeye Name: 2-[3-[[(5-phenyl-2-furyl)methyl-(3-pyridylsulfonyl)amino]methyl]phenyl]acetic acid CAS Name: 2-[3-[[(5-phenyl-2-furanyl)methyl-(3-pyridinylsulfonyl)amino]methyl]phenyl]acetic acid IUPAC Name: 2-[3-[[(5-phenylfuran-2-yl)methyl-pyridin-3-ylsulfonylamino]methyl]phenyl]acetic acid Traditional Name: 2-[3-[[(5-phenyl-2-furyl)methyl-(3-pyridylsulfonyl)amino]methyl]phenyl]acetic acid Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(O2)CN(CC3=CC=CC(=C3)CC(=O)O)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(O2)CN(CC3=CC=CC(=C3)CC(=O)O)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H22N2O5S/c28-25(29)15-19-6-4-7-20(14-19)17-27(33(30,31)23-10-5-13-26-16-23)18-22-11-12-24(32-22)21-8-2-1-3-9-21/h1-14,16H,15,17-18H2,(H,28,29)