2-azanyl-4-methylsulfanyl-2-(2-phenylphenyl)carbonyl-4-(pyridin-3-ylmethylsulfanyl)butanoic acid

Systemtic Name: 2-azanyl-4-methylsulfanyl-2-(2-phenylphenyl)carbonyl-4-(pyridin-3-ylmethylsulfanyl)butanoic acid Openeye Name: 2-amino-4-methylsulfanyl-2-(2-phenylbenzoyl)-4-(3-pyridylmethylsulfanyl)butanoic acid CAS Name: 2-amino-4-(methylthio)-2-[oxo-(2-phenylphenyl)methyl]-4-(3-pyridinylmethylthio)butanoic acid IUPAC Name: 2-amino-4-methylsulfanyl-2-(2-phenylbenzoyl)-4-(pyridin-3-ylmethylsulfanyl)butanoic acid Traditional Name: 2-amino-4-(methylthio)-2-(2-phenylbenzoyl)-4-(3-pyridylmethylthio)butyric acid Formula: C24H24N2O3S2 MolecularWeight: 452.58896

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(C(=O)C1=CC=CC=C1C2=CC=CC=C2)(C(=O)O)N)SCC3=CN=CC=C3

Isomeric SMILES

CSC(CC(C(=O)C1=CC=CC=C1C2=CC=CC=C2)(C(=O)O)N)SCC3=CN=CC=C3

InChI

InChI=1S/C24H24N2O3S2/c1-30-21(31-16-17-8-7-13-26-15-17)14-24(25,23(28)29)22(27)20-12-6-5-11-19(20)18-9-3-2-4-10-18/h2-13,15,21H,14,16,25H2,1H3,(H,28,29)