3-[2-(2-naphthalen-1-ylpropanoylamino)phenyl]propanethioic S-acid

Systemtic Name: 3-[2-(2-naphthalen-1-ylpropanoylamino)phenyl]propanethioic S-acid Openeye Name: 3-[2-[2-(1-naphthyl)propanoylamino]phenyl]propanethioic S-acid CAS Name: 3-[2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]propanethioic S-acid IUPAC Name: 3-[2-(2-naphthalen-1-ylpropanoylamino)phenyl]propanethioic S-acid Traditional Name: 3-[2-[2-(1-naphthyl)propanoylamino]phenyl]thiopropionic acid Formula: C22H21NO2S MolecularWeight: 363.47264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CCC(=O)S

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CCC(=O)S

InChI

InChI=1S/C22H21NO2S/c1-15(18-11-6-9-16-7-2-4-10-19(16)18)22(25)23-20-12-5-3-8-17(20)13-14-21(24)26/h2-12,15H,13-14H2,1H3,(H,23,25)(H,24,26)