(2R)-4-methylsulfanyl-2-[(5E)-4-oxidanylidene-5-(quinoxalin-6-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate

Systemtic Name: (2R)-4-methylsulfanyl-2-[(5E)-4-oxidanylidene-5-(quinoxalin-6-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Openeye Name: (2R)-4-methylsulfanyl-2-[(5E)-4-oxo-5-(quinoxalin-6-ylmethylene)-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: (2R)-4-(methylthio)-2-[(5E)-4-oxo-5-(6-quinoxalinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]butanoate IUPAC Name: (2R)-4-methylsulfanyl-2-[(5E)-4-oxo-5-(quinoxalin-6-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoate Traditional Name: (2R)-2-[(5E)-4-keto-5-(quinoxalin-6-ylmethylene)-2-thioxo-thiazolidin-3-yl]-4-(methylthio)butyrate Formula: C17H14N3O3S3- MolecularWeight: 404.50636

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)[O-])N1C(=O)C(=CC2=CC3=NC=CN=C3C=C2)SC1=S

Isomeric SMILES

CSCC[C@H](C(=O)[O-])N1C(=O)/C(=C\C2=CC3=NC=CN=C3C=C2)/SC1=S

InChI

InChI=1S/C17H15N3O3S3/c1-25-7-4-13(16(22)23)20-15(21)14(26-17(20)24)9-10-2-3-11-12(8-10)19-6-5-18-11/h2-3,5-6,8-9,13H,4,7H2,1H3,(H,22,23)/p-1/b14-9+/t13-/m1/s1