2-[3-[[1-(1H-indol-3-yl)ethyl-pyridin-3-ylsulfonyl-amino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[[1-(1H-indol-3-yl)ethyl-pyridin-3-ylsulfonyl-amino]methyl]phenyl]ethanoic acid Openeye Name: 2-[3-[[1-(1H-indol-3-yl)ethyl-(3-pyridylsulfonyl)amino]methyl]phenyl]acetic acid CAS Name: 2-[3-[[1-(1H-indol-3-yl)ethyl-(3-pyridinylsulfonyl)amino]methyl]phenyl]acetic acid IUPAC Name: 2-[3-[[1-(1H-indol-3-yl)ethyl-pyridin-3-ylsulfonylamino]methyl]phenyl]acetic acid Traditional Name: 2-[3-[[1-(1H-indol-3-yl)ethyl-(3-pyridylsulfonyl)amino]methyl]phenyl]acetic acid Formula: C24H23N3O4S MolecularWeight: 449.52212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC2=CC=CC=C21)N(CC3=CC=CC(=C3)CC(=O)O)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC(C1=CNC2=CC=CC=C21)N(CC3=CC=CC(=C3)CC(=O)O)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C24H23N3O4S/c1-17(22-15-26-23-10-3-2-9-21(22)23)27(32(30,31)20-8-5-11-25-14-20)16-19-7-4-6-18(12-19)13-24(28)29/h2-12,14-15,17,26H,13,16H2,1H3,(H,28,29)