(2S)-2-azanyl-3-methyl-3-[2-[(phenylmethyl)carbamoyl]phenyl]selanylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-azanyl-3-methyl-3-[2-[(phenylmethyl)carbamoyl]phenyl]selanylsulfanyl-butanoic acid Openeye Name: (2S)-2-amino-3-[2-(benzylcarbamoyl)phenyl]selanylsulfanyl-3-methyl-butanoic acid CAS Name: (2S)-2-amino-3-methyl-3-[[[2-[oxo-[(phenylmethyl)amino]methyl]phenyl]seleno]thio]butanoic acid IUPAC Name: (2S)-2-amino-3-[2-(benzylcarbamoyl)phenyl]selanylsulfanyl-3-methylbutanoic acid Traditional Name: (2S)-2-amino-3-[[[2-(benzylcarbamoyl)phenyl]seleno]thio]-3-methyl-butyric acid Formula: C19H22N2O3SSe MolecularWeight: 437.41458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)O)N)S[Se]C1=CC=CC=C1C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)([C@H](C(=O)O)N)S[Se]C1=CC=CC=C1C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C19H22N2O3SSe/c1-19(2,16(20)18(23)24)25-26-15-11-7-6-10-14(15)17(22)21-12-13-8-4-3-5-9-13/h3-11,16H,12,20H2,1-2H3,(H,21,22)(H,23,24)/t16-/m0/s1