1-[2-[5-(furan-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methyl-butanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[5-(furan-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methyl-butanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[5-(2-furylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]-3-methyl-butanoyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[5-(2-furanylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-methyl-1-oxobutyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-methylbutanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[5-(2-furfurylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-3-methyl-butanoyl]isonipecotic acid Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)C(=O)O)N2C(=O)C(=CC3=CC=CO3)SC2=S

Isomeric SMILES

CC(C)C(C(=O)N1CCC(CC1)C(=O)O)N2C(=O)C(=CC3=CC=CO3)SC2=S

InChI

InChI=1S/C19H22N2O5S2/c1-11(2)15(17(23)20-7-5-12(6-8-20)18(24)25)21-16(22)14(28-19(21)27)10-13-4-3-9-26-13/h3-4,9-12,15H,5-8H2,1-2H3,(H,24,25)