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

Systemtic Name: 2-(2-naphthalen-1-ylpropanoylamino)-3-phenyl-propanethioic S-acid Openeye Name: 2-[2-(1-naphthyl)propanoylamino]-3-phenyl-propanethioic S-acid CAS Name: 2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]-3-phenylpropanethioic S-acid IUPAC Name: 2-(2-naphthalen-1-ylpropanoylamino)-3-phenylpropanethioic S-acid Traditional Name: 2-[2-(1-naphthyl)propanoylamino]-3-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)NC(CC3=CC=CC=C3)C(=O)S

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC(CC3=CC=CC=C3)C(=O)S

InChI

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