2-acetamido-4-[2-(phenylcarbamoyl)phenyl]selanylsulfanyl-butanoic acid

Systemtic Name: 2-acetamido-4-[2-(phenylcarbamoyl)phenyl]selanylsulfanyl-butanoic acid Openeye Name: 2-acetamido-4-[2-(phenylcarbamoyl)phenyl]selanylsulfanyl-butanoic acid CAS Name: 2-acetamido-4-[[[2-[anilino(oxo)methyl]phenyl]seleno]thio]butanoic acid IUPAC Name: 2-acetamido-4-[2-(phenylcarbamoyl)phenyl]selanylsulfanylbutanoic acid Traditional Name: 2-acetamido-4-[[[2-(phenylcarbamoyl)phenyl]seleno]thio]butyric acid Formula: C19H20N2O4SSe MolecularWeight: 451.3981

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCS[Se]C1=CC=CC=C1C(=O)NC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(=O)NC(CCS[Se]C1=CC=CC=C1C(=O)NC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H20N2O4SSe/c1-13(22)20-16(19(24)25)11-12-26-27-17-10-6-5-9-15(17)18(23)21-14-7-3-2-4-8-14/h2-10,16H,11-12H2,1H3,(H,20,22)(H,21,23)(H,24,25)