ethyl 2-ethanoyl-3-imidazol-1-yl-2-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: ethyl 2-ethanoyl-3-imidazol-1-yl-2-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,3-thiazolidine-4-carboxylate Openeye Name: ethyl 2-acetyl-2-[(4-allyloxyphenyl)sulfanylmethyl]-3-imidazol-1-yl-thiazolidine-4-carboxylate CAS Name: 2-acetyl-3-(1-imidazolyl)-2-[[(4-prop-2-enoxyphenyl)thio]methyl]-4-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-acetyl-3-imidazol-1-yl-2-[(4-prop-2-enoxyphenyl)sulfanylmethyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 2-acetyl-2-[[(4-allyloxyphenyl)thio]methyl]-3-imidazol-1-yl-thiazolidine-4-carboxylic acid ethyl ester Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(N1N2C=CN=C2)(CSC3=CC=C(C=C3)OCC=C)C(=O)C

Isomeric SMILES

CCOC(=O)C1CSC(N1N2C=CN=C2)(CSC3=CC=C(C=C3)OCC=C)C(=O)C

InChI

InChI=1S/C21H25N3O4S2/c1-4-12-28-17-6-8-18(9-7-17)29-14-21(16(3)25)24(23-11-10-22-15-23)19(13-30-21)20(26)27-5-2/h4,6-11,15,19H,1,5,12-14H2,2-3H3