(2R)-2-[[(3-phenylphenyl)carbonyl-propyl-carbamoyl]amino]-3-phenylsulfanyl-propanoic acid

Systemtic Name: (2R)-2-[[(3-phenylphenyl)carbonyl-propyl-carbamoyl]amino]-3-phenylsulfanyl-propanoic acid Openeye Name: (2R)-2-[[(3-phenylbenzoyl)-propyl-carbamoyl]amino]-3-phenylsulfanyl-propanoic acid CAS Name: (2R)-2-[[oxo-[[oxo-(3-phenylphenyl)methyl]-propylamino]methyl]amino]-3-(phenylthio)propanoic acid IUPAC Name: (2R)-2-[[(3-phenylbenzoyl)-propylcarbamoyl]amino]-3-phenylsulfanylpropanoic acid Traditional Name: (2R)-2-[[(3-phenylbenzoyl)-propyl-carbamoyl]amino]-3-(phenylthio)propionic acid Formula: C26H26N2O4S MolecularWeight: 462.56064

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=O)C1=CC=CC(=C1)C2=CC=CC=C2)C(=O)NC(CSC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCN(C(=O)C1=CC=CC(=C1)C2=CC=CC=C2)C(=O)N[C@@H](CSC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H26N2O4S/c1-2-16-28(24(29)21-13-9-12-20(17-21)19-10-5-3-6-11-19)26(32)27-23(25(30)31)18-33-22-14-7-4-8-15-22/h3-15,17,23H,2,16,18H2,1H3,(H,27,32)(H,30,31)/t23-/m0/s1