(2R)-4-azanyl-2-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-azanyl-2-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-oxidanylidene-butanoate Openeye Name: (2R)-4-amino-2-[(5E)-5-[(1-methylpyrrol-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-4-oxo-butanoate CAS Name: (2R)-4-amino-2-[(5E)-5-[(1-methyl-3-pyrrolyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-4-oxobutanoate IUPAC Name: (2R)-4-amino-2-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-oxobutanoate Traditional Name: (2R)-4-amino-4-keto-2-[(5E)-4-keto-5-[(1-methylpyrrol-3-yl)methylene]-2-thioxo-thiazolidin-3-yl]butyrate Formula: C13H12N3O4S2- MolecularWeight: 338.38208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)C=C2C(=O)N(C(=S)S2)C(CC(=O)N)C(=O)[O-]

Isomeric SMILES

CN1C=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)[C@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C13H13N3O4S2/c1-15-3-2-7(6-15)4-9-11(18)16(13(21)22-9)8(12(19)20)5-10(14)17/h2-4,6,8H,5H2,1H3,(H2,14,17)(H,19,20)/p-1/b9-4+/t8-/m1/s1