3-[3-[[2,4-bis(fluoranyl)phenyl]methylcarbamoylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[3-[[2,4-bis(fluoranyl)phenyl]methylcarbamoylamino]-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[3-[(2,4-difluorophenyl)methylcarbamoylamino]-2-hydroxy-4-phenyl-butanoyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid CAS Name: 3-[3-[[[(2,4-difluorophenyl)methylamino]-oxomethyl]amino]-2-hydroxy-1-oxo-4-phenylbutyl]-5,5-dimethyl-4-thiazolidinecarboxylic acid IUPAC Name: 3-[3-[(2,4-difluorophenyl)methylcarbamoylamino]-2-hydroxy-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[3-[(2,4-difluorobenzyl)carbamoylamino]-2-hydroxy-4-phenyl-butanoyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid Formula: C24H27F2N3O5S MolecularWeight: 507.550086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CS1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)NCC3=C(C=C(C=C3)F)F)O)C(=O)O)C

Isomeric SMILES

CC1(C(N(CS1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)NCC3=C(C=C(C=C3)F)F)O)C(=O)O)C

InChI

InChI=1S/C24H27F2N3O5S/c1-24(2)20(22(32)33)29(13-35-24)21(31)19(30)18(10-14-6-4-3-5-7-14)28-23(34)27-12-15-8-9-16(25)11-17(15)26/h3-9,11,18-20,30H,10,12-13H2,1-2H3,(H,32,33)(H2,27,28,34)