3-[3-(2,5-dimethylphenyl)sulfanyl-5-propan-2-yl-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-yl]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[3-(2,5-dimethylphenyl)sulfanyl-5-propan-2-yl-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-yl]-2,2-dimethyl-propanoic acid Openeye Name: 3-[3-(2,5-dimethylphenyl)sulfanyl-5-isopropyl-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-yl]-2,2-dimethyl-propanoic acid CAS Name: 3-[3-[(2,5-dimethylphenyl)thio]-5-propan-2-yl-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolyl]-2,2-dimethylpropanoic acid IUPAC Name: 3-[3-(2,5-dimethylphenyl)sulfanyl-5-propan-2-yl-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-yl]-2,2-dimethylpropanoic acid Traditional Name: 3-[3-[(2,5-dimethylphenyl)thio]-5-isopropyl-1-[3-(trifluoromethyl)benzyl]indol-2-yl]-2,2-dimethyl-propionic acid Formula: C32H34F3NO2S MolecularWeight: 553.67807

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(N(C3=C2C=C(C=C3)C(C)C)CC4=CC(=CC=C4)C(F)(F)F)CC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(N(C3=C2C=C(C=C3)C(C)C)CC4=CC(=CC=C4)C(F)(F)F)CC(C)(C)C(=O)O

InChI

InChI=1S/C32H34F3NO2S/c1-19(2)23-12-13-26-25(16-23)29(39-28-14-20(3)10-11-21(28)4)27(17-31(5,6)30(37)38)36(26)18-22-8-7-9-24(15-22)32(33,34)35/h7-16,19H,17-18H2,1-6H3,(H,37,38)