butyl (2S,4S)-3-butanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: butyl (2S,4S)-3-butanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate Openeye Name: butyl (2S,4S)-3-butanoyl-2-phenyl-thiazolidine-4-carboxylate CAS Name: (2S,4S)-3-(1-oxobutyl)-2-phenyl-4-thiazolidinecarboxylic acid butyl ester IUPAC Name: butyl (2S,4S)-3-butanoyl-2-phenyl-1,3-thiazolidine-4-carboxylate Traditional Name: (2S,4S)-3-butyryl-2-phenyl-thiazolidine-4-carboxylic acid butyl ester Formula: C18H25NO3S MolecularWeight: 335.461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSC(N1C(=O)CCC)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)[C@H]1CS[C@H](N1C(=O)CCC)C2=CC=CC=C2

InChI

InChI=1S/C18H25NO3S/c1-3-5-12-22-18(21)15-13-23-17(14-10-7-6-8-11-14)19(15)16(20)9-4-2/h6-8,10-11,15,17H,3-5,9,12-13H2,1-2H3/t15-,17+/m1/s1