3-[4-(8-cyclohexyloctylamino)phenyl]carbonyl-1,3-thiazolidine-2-carboxylic acid

Systemtic Name: 3-[4-(8-cyclohexyloctylamino)phenyl]carbonyl-1,3-thiazolidine-2-carboxylic acid Openeye Name: 3-[4-(8-cyclohexyloctylamino)benzoyl]thiazolidine-2-carboxylic acid CAS Name: 3-[[4-(8-cyclohexyloctylamino)phenyl]-oxomethyl]-2-thiazolidinecarboxylic acid IUPAC Name: 3-[4-(8-cyclohexyloctylamino)benzoyl]-1,3-thiazolidine-2-carboxylic acid Traditional Name: 3-[4-(8-cyclohexyloctylamino)benzoyl]thiazolidine-2-carboxylic acid Formula: C25H38N2O3S MolecularWeight: 446.64582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCCCCCCNC2=CC=C(C=C2)C(=O)N3CCSC3C(=O)O

Isomeric SMILES

C1CCC(CC1)CCCCCCCCNC2=CC=C(C=C2)C(=O)N3CCSC3C(=O)O

InChI

InChI=1S/C25H38N2O3S/c28-23(27-18-19-31-24(27)25(29)30)21-13-15-22(16-14-21)26-17-9-4-2-1-3-6-10-20-11-7-5-8-12-20/h13-16,20,24,26H,1-12,17-19H2,(H,29,30)