4-[(5E)-4-oxidanylidene-5-(piperidin-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Systemtic Name: 4-[(5E)-4-oxidanylidene-5-(piperidin-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[(5E)-4-oxo-5-(1-piperidylmethylene)-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[(5E)-4-oxo-5-(1-piperidinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[(5E)-4-oxo-5-(piperidin-1-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[(5E)-4-keto-5-(piperidinomethylene)-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C13H18N2O3S2 MolecularWeight: 314.42362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C=C2C(=O)N(C(=S)S2)CCCC(=O)O

Isomeric SMILES

C1CCN(CC1)/C=C/2\C(=O)N(C(=S)S2)CCCC(=O)O

InChI

InChI=1S/C13H18N2O3S2/c16-11(17)5-4-8-15-12(18)10(20-13(15)19)9-14-6-2-1-3-7-14/h9H,1-8H2,(H,16,17)/b10-9+