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

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

CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)CC(CC2=CC=CC=C2)S

Isomeric SMILES

CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)CC(CC2=CC=CC=C2)S

InChI

InChI=1S/C21H25NO3S/c1-15(21(24)25)22-20(23)18(12-16-8-4-2-5-9-16)14-19(26)13-17-10-6-3-7-11-17/h2-11,15,18-19,26H,12-14H2,1H3,(H,22,23)(H,24,25)