2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-[[3-(trifluoromethyl)phenyl]methyl]thiazole-4-carboxamide CAS Name: 2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-4-thiazolecarboxamide IUPAC Name: 2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-tert-butylbenzyl)-(4-fluorobenzyl)amino]methyl]-N-[3-(trifluoromethyl)benzyl]thiazole-4-carboxamide Formula: C31H31F4N3OS MolecularWeight: 569.655953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)F)CC3=NC(=CS3)C(=O)NCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)F)CC3=NC(=CS3)C(=O)NCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C31H31F4N3OS/c1-30(2,3)24-11-7-21(8-12-24)17-38(18-22-9-13-26(32)14-10-22)19-28-37-27(20-40-28)29(39)36-16-23-5-4-6-25(15-23)31(33,34)35/h4-15,20H,16-19H2,1-3H3,(H,36,39)