3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-(2-fluorophenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-(2-fluorophenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-(2-fluorophenyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(4-tert-butylphenoxy)ethylthio]-5-(2-fluorophenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-(2-fluorophenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[2-(4-tert-butylphenoxy)ethylthio]-5-(2-fluorophenyl)-1,2,4-triazol-4-yl]amine Formula: C20H23FN4OS MolecularWeight: 386.486223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCSC2=NN=C(N2N)C3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCSC2=NN=C(N2N)C3=CC=CC=C3F

InChI

InChI=1S/C20H23FN4OS/c1-20(2,3)14-8-10-15(11-9-14)26-12-13-27-19-24-23-18(25(19)22)16-6-4-5-7-17(16)21/h4-11H,12-13,22H2,1-3H3