dimethyl (2S,4S)-3-[2-(4-phenylpiperazin-1-yl)ethanoyl]-1,3-thiazolidine-2,4-dicarboxylate

Systemtic Name: dimethyl (2S,4S)-3-[2-(4-phenylpiperazin-1-yl)ethanoyl]-1,3-thiazolidine-2,4-dicarboxylate Openeye Name: dimethyl (2S,4S)-3-[2-(4-phenylpiperazin-1-yl)acetyl]thiazolidine-2,4-dicarboxylate CAS Name: (2S,4S)-3-[1-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thiazolidine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,4S)-3-[2-(4-phenylpiperazin-1-yl)acetyl]-1,3-thiazolidine-2,4-dicarboxylate Traditional Name: (2S,4S)-3-[2-(4-phenylpiperazino)acetyl]thiazolidine-2,4-dicarboxylic acid dimethyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CSC(N1C(=O)CN2CCN(CC2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)[C@H]1CS[C@H](N1C(=O)CN2CCN(CC2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C19H25N3O5S/c1-26-18(24)15-13-28-17(19(25)27-2)22(15)16(23)12-20-8-10-21(11-9-20)14-6-4-3-5-7-14/h3-7,15,17H,8-13H2,1-2H3/t15-,17+/m1/s1