3-[[5-phenyl-2-(phenylmethyl)-4-sulfanyl-pentanoyl]amino]propanoic acid

Systemtic Name: 3-[[5-phenyl-2-(phenylmethyl)-4-sulfanyl-pentanoyl]amino]propanoic acid Openeye Name: 3-[(2-benzyl-5-phenyl-4-sulfanyl-pentanoyl)amino]propanoic acid CAS Name: 3-[[4-mercapto-1-oxo-5-phenyl-2-(phenylmethyl)pentyl]amino]propanoic acid IUPAC Name: 3-[(2-benzyl-5-phenyl-4-sulfanylpentanoyl)amino]propanoic acid Traditional Name: 3-[(2-benzyl-4-mercapto-5-phenyl-pentanoyl)amino]propionic acid Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(CC2=CC=CC=C2)S)C(=O)NCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CC(CC2=CC=CC=C2)S)C(=O)NCCC(=O)O

InChI

InChI=1S/C21H25NO3S/c23-20(24)11-12-22-21(25)18(13-16-7-3-1-4-8-16)15-19(26)14-17-9-5-2-6-10-17/h1-10,18-19,26H,11-15H2,(H,22,25)(H,23,24)