(2S)-4-methylsulfanyl-2-[(5E)-4-oxidanylidene-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: (2S)-4-methylsulfanyl-2-[(5E)-4-oxidanylidene-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: (2S)-4-methylsulfanyl-2-[(5E)-4-oxo-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: (2S)-4-(methylthio)-2-[(5E)-4-oxo-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: (2S)-4-methylsulfanyl-2-[(5E)-4-oxo-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: (2S)-2-[(5E)-4-keto-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-thiazolidin-3-yl]-4-(methylthio)butyrate Formula: C13H13N2O3S3- MolecularWeight: 341.44892

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])N1C(=O)C(=CC2=CC=CN2)SC1=S

Isomeric SMILES

CSCC[C@@H](C(=O)[O-])N1C(=O)/C(=C\C2=CC=CN2)/SC1=S

InChI

InChI=1S/C13H14N2O3S3/c1-20-6-4-9(12(17)18)15-11(16)10(21-13(15)19)7-8-3-2-5-14-8/h2-3,5,7,9,14H,4,6H2,1H3,(H,17,18)/p-1/b10-7+/t9-/m0/s1