ethyl 3-(3-oxidanylidenebutanethioyl)-2-[(2-prop-2-ynoxyphenoxy)methyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: ethyl 3-(3-oxidanylidenebutanethioyl)-2-[(2-prop-2-ynoxyphenoxy)methyl]-1,3-thiazolidine-4-carboxylate Openeye Name: ethyl 3-(3-oxobutanethioyl)-2-[(2-prop-2-ynoxyphenoxy)methyl]thiazolidine-4-carboxylate CAS Name: 3-(3-oxo-1-sulfanylidenebutyl)-2-[(2-prop-2-ynoxyphenoxy)methyl]-4-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-oxobutanethioyl)-2-[(2-prop-2-ynoxyphenoxy)methyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(3-ketobutanethioyl)-2-[(2-propargyloxyphenoxy)methyl]thiazolidine-4-carboxylic acid ethyl ester Formula: C20H23NO5S2 MolecularWeight: 421.53032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(N1C(=S)CC(=O)C)COC2=CC=CC=C2OCC#C

Isomeric SMILES

CCOC(=O)C1CSC(N1C(=S)CC(=O)C)COC2=CC=CC=C2OCC#C

InChI

InChI=1S/C20H23NO5S2/c1-4-10-25-16-8-6-7-9-17(16)26-12-19-21(18(27)11-14(3)22)15(13-28-19)20(23)24-5-2/h1,6-9,15,19H,5,10-13H2,2-3H3