3-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine Openeye Name: 3-[2-(4-isopropyl-3-methyl-phenoxy)ethylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(3-methyl-4-propan-2-ylphenoxy)ethylthio]-5-(trifluoromethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(3-methyl-4-propan-2-ylphenoxy)ethylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine Traditional Name: [3-[2-(4-isopropyl-3-methyl-phenoxy)ethylthio]-5-(trifluoromethyl)-1,2,4-triazol-4-yl]amine Formula: C15H19F3N4OS MolecularWeight: 360.39777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCSC2=NN=C(N2N)C(F)(F)F)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCSC2=NN=C(N2N)C(F)(F)F)C(C)C

InChI

InChI=1S/C15H19F3N4OS/c1-9(2)12-5-4-11(8-10(12)3)23-6-7-24-14-21-20-13(22(14)19)15(16,17)18/h4-5,8-9H,6-7,19H2,1-3H3