2-[cyclopentyl-[2-sulfanyl-5-(trifluoromethyl)phenyl]carbonyl-amino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[cyclopentyl-[2-sulfanyl-5-(trifluoromethyl)phenyl]carbonyl-amino]-2-phenyl-ethanoic acid Openeye Name: 2-[cyclopentyl-[2-sulfanyl-5-(trifluoromethyl)benzoyl]amino]-2-phenyl-acetic acid CAS Name: 2-[cyclopentyl-[[2-mercapto-5-(trifluoromethyl)phenyl]-oxomethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[cyclopentyl-[2-sulfanyl-5-(trifluoromethyl)benzoyl]amino]-2-phenylacetic acid Traditional Name: 2-[cyclopentyl-[2-mercapto-5-(trifluoromethyl)benzoyl]amino]-2-phenyl-acetic acid Formula: C21H20F3NO3S MolecularWeight: 423.44861

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(C(C2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=CC(=C3)C(F)(F)F)S

Isomeric SMILES

C1CCC(C1)N(C(C2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=CC(=C3)C(F)(F)F)S

InChI

InChI=1S/C21H20F3NO3S/c22-21(23,24)14-10-11-17(29)16(12-14)19(26)25(15-8-4-5-9-15)18(20(27)28)13-6-2-1-3-7-13/h1-3,6-7,10-12,15,18,29H,4-5,8-9H2,(H,27,28)