2-[[4-(4-methylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[4-(4-methylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[[5-benzyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]thiazole-4-carboxamide CAS Name: 2-[[[4-(4-methylphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-4-thiazolecarboxamide IUPAC Name: 2-[[5-benzyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[[5-benzyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]-N-[3-(trifluoromethyl)benzyl]thiazole-4-carboxamide Formula: C29H24F3N5OS2 MolecularWeight: 579.65897

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=CS3)C(=O)NCC4=CC(=CC=C4)C(F)(F)F)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=CS3)C(=O)NCC4=CC(=CC=C4)C(F)(F)F)CC5=CC=CC=C5

InChI

InChI=1S/C29H24F3N5OS2/c1-19-10-12-23(13-11-19)37-25(15-20-6-3-2-4-7-20)35-36-28(37)40-18-26-34-24(17-39-26)27(38)33-16-21-8-5-9-22(14-21)29(30,31)32/h2-14,17H,15-16,18H2,1H3,(H,33,38)