(2R)-4-methyl-2-[(5E)-4-oxidanylidene-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid

Systemtic Name: (2R)-4-methyl-2-[(5E)-4-oxidanylidene-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Openeye Name: (2R)-4-methyl-2-[(5E)-4-oxo-5-(3-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]pentanoic acid CAS Name: (2R)-4-methyl-2-[(5E)-4-oxo-5-(3-pyridinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]pentanoic acid IUPAC Name: (2R)-4-methyl-2-[(5E)-4-oxo-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid Traditional Name: (2R)-2-[(5E)-4-keto-5-(3-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]-4-methyl-valeric acid Formula: C15H16N2O3S2 MolecularWeight: 336.42914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N1C(=O)C(=CC2=CN=CC=C2)SC1=S

Isomeric SMILES

CC(C)C[C@H](C(=O)O)N1C(=O)/C(=C\C2=CN=CC=C2)/SC1=S

InChI

InChI=1S/C15H16N2O3S2/c1-9(2)6-11(14(19)20)17-13(18)12(22-15(17)21)7-10-4-3-5-16-8-10/h3-5,7-9,11H,6H2,1-2H3,(H,19,20)/b12-7+/t11-/m1/s1