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

Systemtic Name: tert-butyl 4-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate Openeye Name: tert-butyl 4-[(E)-(3-methyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]benzoate CAS Name: 4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoate Traditional Name: 4-[(E)-(4-keto-3-methyl-2-thioxo-thiazolidin-5-ylidene)methyl]benzoic acid tert-butyl ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)C

InChI

InChI=1S/C16H17NO3S2/c1-16(2,3)20-14(19)11-7-5-10(6-8-11)9-12-13(18)17(4)15(21)22-12/h5-9H,1-4H3/b12-9+