4-methylsulfanyl-2-[[2-[(4-phenylphenyl)carbonylamino]phenyl]carbonylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[[2-[(4-phenylphenyl)carbonylamino]phenyl]carbonylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[[2-[(4-phenylbenzoyl)amino]benzoyl]amino]butanoic acid CAS Name: 4-(methylthio)-2-[[oxo-[2-[[oxo-(4-phenylphenyl)methyl]amino]phenyl]methyl]amino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[[2-[(4-phenylbenzoyl)amino]benzoyl]amino]butanoic acid Traditional Name: 4-(methylthio)-2-[[2-[(4-phenylbenzoyl)amino]benzoyl]amino]butyric acid Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H24N2O4S/c1-32-16-15-22(25(30)31)27-24(29)20-9-5-6-10-21(20)26-23(28)19-13-11-18(12-14-19)17-7-3-2-4-8-17/h2-14,22H,15-16H2,1H3,(H,26,28)(H,27,29)(H,30,31)