3-(2-imidazol-1-ylethanoyl)-2-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(2-imidazol-1-ylethanoyl)-2-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-[(4-allyloxyphenyl)sulfanylmethyl]-3-(2-imidazol-1-ylacetyl)thiazolidine-4-carboxylic acid CAS Name: 3-[2-(1-imidazolyl)-1-oxoethyl]-2-[[(4-prop-2-enoxyphenyl)thio]methyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(2-imidazol-1-ylacetyl)-2-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-[[(4-allyloxyphenyl)thio]methyl]-3-(2-imidazol-1-ylacetyl)thiazolidine-4-carboxylic acid Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)SCC2N(C(CS2)C(=O)O)C(=O)CN3C=CN=C3

Isomeric SMILES

C=CCOC1=CC=C(C=C1)SCC2N(C(CS2)C(=O)O)C(=O)CN3C=CN=C3

InChI

InChI=1S/C19H21N3O4S2/c1-2-9-26-14-3-5-15(6-4-14)27-12-18-22(16(11-28-18)19(24)25)17(23)10-21-8-7-20-13-21/h2-8,13,16,18H,1,9-12H2,(H,24,25)