2,3-bis[(3-phenyl-2-sulfanyl-propanoyl)amino]propanoic acid

Systemtic Name: 2,3-bis[(3-phenyl-2-sulfanyl-propanoyl)amino]propanoic acid Openeye Name: 2,3-bis[(3-phenyl-2-sulfanyl-propanoyl)amino]propanoic acid CAS Name: 2,3-bis[(2-mercapto-1-oxo-3-phenylpropyl)amino]propanoic acid IUPAC Name: 2,3-bis[(3-phenyl-2-sulfanylpropanoyl)amino]propanoic acid Traditional Name: 2,3-bis[(2-mercapto-3-phenyl-propanoyl)amino]propionic acid Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4S2/c24-19(17(28)11-14-7-3-1-4-8-14)22-13-16(21(26)27)23-20(25)18(29)12-15-9-5-2-6-10-15/h1-10,16-18,28-29H,11-13H2,(H,22,24)(H,23,25)(H,26,27)