tert-butyl (2S,4S)-2-(4-chlorophenyl)-4-(4-phenylpiperazin-1-yl)carbonyl-1,3-thiazolidine-3-carboxylate

Systemtic Name: tert-butyl (2S,4S)-2-(4-chlorophenyl)-4-(4-phenylpiperazin-1-yl)carbonyl-1,3-thiazolidine-3-carboxylate Openeye Name: tert-butyl (2S,4S)-2-(4-chlorophenyl)-4-(4-phenylpiperazine-1-carbonyl)thiazolidine-3-carboxylate CAS Name: (2S,4S)-2-(4-chlorophenyl)-4-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-thiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4S)-2-(4-chlorophenyl)-4-(4-phenylpiperazine-1-carbonyl)-1,3-thiazolidine-3-carboxylate Traditional Name: (2S,4S)-2-(4-chlorophenyl)-4-(4-phenylpiperazine-1-carbonyl)thiazolidine-3-carboxylic acid tert-butyl ester Formula: C25H30ClN3O3S MolecularWeight: 488.042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CSC1C2=CC=C(C=C2)Cl)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H](CS[C@H]1C2=CC=C(C=C2)Cl)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H30ClN3O3S/c1-25(2,3)32-24(31)29-21(17-33-23(29)18-9-11-19(26)12-10-18)22(30)28-15-13-27(14-16-28)20-7-5-4-6-8-20/h4-12,21,23H,13-17H2,1-3H3/t21-,23+/m1/s1