4-[[[4-[4-[cyclohexylmethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]phenyl]-1,3-thiazol-2-yl]-methyl-amino]methyl]benzoic acid

Systemtic Name: 4-[[[4-[4-[cyclohexylmethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]phenyl]-1,3-thiazol-2-yl]-methyl-amino]methyl]benzoic acid Openeye Name: 4-[[[4-[4-[cyclohexylmethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]phenyl]thiazol-2-yl]-methyl-amino]methyl]benzoic acid CAS Name: 4-[[[4-[4-[cyclohexylmethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]phenyl]-2-thiazolyl]-methylamino]methyl]benzoic acid IUPAC Name: 4-[[[4-[4-[cyclohexylmethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]phenyl]-1,3-thiazol-2-yl]-methylamino]methyl]benzoic acid Traditional Name: 4-[[[4-[4-[cyclohexylmethyl-[4-(trifluoromethyl)benzyl]amino]phenyl]thiazol-2-yl]-methyl-amino]methyl]benzoic acid Formula: C33H34F3N3O2S MolecularWeight: 593.70217

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)O)C2=NC(=CS2)C3=CC=C(C=C3)N(CC4CCCCC4)CC5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)O)C2=NC(=CS2)C3=CC=C(C=C3)N(CC4CCCCC4)CC5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C33H34F3N3O2S/c1-38(19-24-7-11-27(12-8-24)31(40)41)32-37-30(22-42-32)26-13-17-29(18-14-26)39(20-23-5-3-2-4-6-23)21-25-9-15-28(16-10-25)33(34,35)36/h7-18,22-23H,2-6,19-21H2,1H3,(H,40,41)