2-naphthalen-1-yl-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-naphthalen-1-yl-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[(2-benzyl-3-sulfanyl-propanoyl)amino]-2-(1-naphthyl)acetic acid CAS Name: 2-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]-2-(1-naphthalenyl)acetic acid IUPAC Name: 2-[(2-benzyl-3-sulfanylpropanoyl)amino]-2-naphthalen-1-ylacetic acid Traditional Name: 2-[(2-benzyl-3-mercapto-propanoyl)amino]-2-(1-naphthyl)acetic acid Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS)C(=O)NC(C2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CS)C(=O)NC(C2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C22H21NO3S/c24-21(17(14-27)13-15-7-2-1-3-8-15)23-20(22(25)26)19-12-6-10-16-9-4-5-11-18(16)19/h1-12,17,20,27H,13-14H2,(H,23,24)(H,25,26)