2-azanyl-4-methylsulfanyl-2-(2-phenylphenyl)carbonyl-4-(sulfonylamino)butanoic acid

Systemtic Name: 2-azanyl-4-methylsulfanyl-2-(2-phenylphenyl)carbonyl-4-(sulfonylamino)butanoic acid Openeye Name: 2-amino-4-methylsulfanyl-2-(2-phenylbenzoyl)-4-(sulfonylamino)butanoic acid CAS Name: 2-amino-4-(methylthio)-2-[oxo-(2-phenylphenyl)methyl]-4-(sulfonylamino)butanoic acid IUPAC Name: 2-amino-4-methylsulfanyl-2-(2-phenylbenzoyl)-4-(sulfonylamino)butanoic acid Traditional Name: 2-amino-4-(methylthio)-2-(2-phenylbenzoyl)-4-(sulfonylamino)butyric acid Formula: C18H18N2O5S2 MolecularWeight: 406.47592

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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)N=S(=O)=O

Isomeric SMILES

CSC(CC(C(=O)C1=CC=CC=C1C2=CC=CC=C2)(C(=O)O)N)N=S(=O)=O

InChI

InChI=1S/C18H18N2O5S2/c1-26-15(20-27(24)25)11-18(19,17(22)23)16(21)14-10-6-5-9-13(14)12-7-3-2-4-8-12/h2-10,15H,11,19H2,1H3,(H,22,23)