4-[(Z)-(3-tert-butyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate

Systemtic Name: 4-[(Z)-(3-tert-butyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate Openeye Name: 4-[(Z)-(3-tert-butyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]benzoate CAS Name: 4-[(Z)-(3-tert-butyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]benzoate IUPAC Name: 4-[(Z)-(3-tert-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate Traditional Name: 4-[(Z)-(3-tert-butyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]benzoate Formula: C15H14NO3S2- MolecularWeight: 320.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=CC2=CC=C(C=C2)C(=O)[O-])SC1=S

Isomeric SMILES

CC(C)(C)N1C(=O)/C(=C/C2=CC=C(C=C2)C(=O)[O-])/SC1=S

InChI

InChI=1S/C15H15NO3S2/c1-15(2,3)16-12(17)11(21-14(16)20)8-9-4-6-10(7-5-9)13(18)19/h4-8H,1-3H3,(H,18,19)/p-1/b11-8-