2-azanyl-4-[2-[(phenylmethyl)carbamoyl]phenyl]selanylsulfanyl-butanoic acid

Systemtic Name: 2-azanyl-4-[2-[(phenylmethyl)carbamoyl]phenyl]selanylsulfanyl-butanoic acid Openeye Name: 2-amino-4-[2-(benzylcarbamoyl)phenyl]selanylsulfanyl-butanoic acid CAS Name: 2-amino-4-[[[2-[oxo-[(phenylmethyl)amino]methyl]phenyl]seleno]thio]butanoic acid IUPAC Name: 2-amino-4-[2-(benzylcarbamoyl)phenyl]selanylsulfanylbutanoic acid Traditional Name: 2-amino-4-[[[2-(benzylcarbamoyl)phenyl]seleno]thio]butyric acid Formula: C18H20N2O3SSe MolecularWeight: 423.388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2[Se]SCCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2[Se]SCCC(C(=O)O)N

InChI

InChI=1S/C18H20N2O3SSe/c19-15(18(22)23)10-11-24-25-16-9-5-4-8-14(16)17(21)20-12-13-6-2-1-3-7-13/h1-9,15H,10-12,19H2,(H,20,21)(H,22,23)