[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] (4R)-3-(phenylcarbonyl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] (4R)-3-(phenylcarbonyl)-1,3-thiazolidine-4-carboxylate Openeye Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl] (4R)-3-benzoylthiazolidine-4-carboxylate CAS Name: (4R)-3-benzoyl-4-thiazolidinecarboxylic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] (4R)-3-benzoyl-1,3-thiazolidine-4-carboxylate Traditional Name: (4R)-3-benzoylthiazolidine-4-carboxylic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl] ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)COC(=O)C3CSCN3C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)COC(=O)[C@@H]3CSCN3C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O4S/c25-20(23-11-10-16-6-4-5-9-18(16)12-23)13-28-22(27)19-14-29-15-24(19)21(26)17-7-2-1-3-8-17/h1-9,19H,10-15H2/t19-/m0/s1