2-[[2-(2-naphthalen-1-ylpropanoylamino)phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[2-(2-naphthalen-1-ylpropanoylamino)phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[2-[2-(1-naphthyl)propanoylamino]phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]methylthio]acetic acid IUPAC Name: 2-[[2-(2-naphthalen-1-ylpropanoylamino)phenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[2-[2-(1-naphthyl)propanoylamino]benzyl]thio]acetic acid Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CSCC(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CSCC(=O)O

InChI

InChI=1S/C22H21NO3S/c1-15(18-11-6-9-16-7-2-4-10-19(16)18)22(26)23-20-12-5-3-8-17(20)13-27-14-21(24)25/h2-12,15H,13-14H2,1H3,(H,23,26)(H,24,25)