(2S)-2-azanyl-3-[(3S)-2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanyl-propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[(3S)-2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]sulfanyl-propanoic acid Openeye Name: (2S)-2-amino-3-[(3S)-2,5-dioxo-1-phenyl-pyrrolidin-3-yl]sulfanyl-propanoic acid CAS Name: (2S)-2-amino-3-[[(3S)-2,5-dioxo-1-phenyl-3-pyrrolidinyl]thio]propanoic acid IUPAC Name: (2S)-2-amino-3-[(3S)-2,5-dioxo-1-phenylpyrrolidin-3-yl]sulfanylpropanoic acid Traditional Name: (2S)-2-amino-3-[[(3S)-2,5-diketo-1-phenyl-pyrrolidin-3-yl]thio]propionic acid Formula: C13H14N2O4S MolecularWeight: 294.32626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=CC=C2)SCC(C(=O)O)N

Isomeric SMILES

C1[C@@H](C(=O)N(C1=O)C2=CC=CC=C2)SC[C@H](C(=O)O)N

InChI

InChI=1S/C13H14N2O4S/c14-9(13(18)19)7-20-10-6-11(16)15(12(10)17)8-4-2-1-3-5-8/h1-5,9-10H,6-7,14H2,(H,18,19)/t9-,10+/m1/s1