methyl 2-acetamido-6-[2-(4-ethylsulfanylphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: methyl 2-acetamido-6-[2-(4-ethylsulfanylphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: methyl 2-acetamido-6-[2-(4-ethylsulfanylphenyl)-4-oxo-thiazolidin-3-yl]hexanoate CAS Name: 2-acetamido-6-[2-[4-(ethylthio)phenyl]-4-oxo-3-thiazolidinyl]hexanoic acid methyl ester IUPAC Name: methyl 2-acetamido-6-[2-(4-ethylsulfanylphenyl)-4-oxo-1,3-thiazolidin-3-yl]hexanoate Traditional Name: 2-acetamido-6-[2-[4-(ethylthio)phenyl]-4-keto-thiazolidin-3-yl]hexanoic acid methyl ester Formula: C20H28N2O4S2 MolecularWeight: 424.57732

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C2N(C(=O)CS2)CCCCC(C(=O)OC)NC(=O)C

Isomeric SMILES

CCSC1=CC=C(C=C1)C2N(C(=O)CS2)CCCCC(C(=O)OC)NC(=O)C

InChI

InChI=1S/C20H28N2O4S2/c1-4-27-16-10-8-15(9-11-16)19-22(18(24)13-28-19)12-6-5-7-17(20(25)26-3)21-14(2)23/h8-11,17,19H,4-7,12-13H2,1-3H3,(H,21,23)