3-[(4-fluorophenyl)methylsulfanyl]-5-[(1-methylnaphthalen-2-yl)oxymethyl]-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanyl]-5-[(1-methylnaphthalen-2-yl)oxymethyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-[(4-fluorophenyl)methylsulfanyl]-5-[(1-methyl-2-naphthyl)oxymethyl]-4-phenyl-1,2,4-triazole CAS Name: 3-[(4-fluorophenyl)methylthio]-5-[(1-methyl-2-naphthalenyl)oxymethyl]-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(4-fluorophenyl)methylsulfanyl]-5-[(1-methylnaphthalen-2-yl)oxymethyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-[(4-fluorobenzyl)thio]-5-[(1-methyl-2-naphthoxy)methyl]-4-phenyl-1,2,4-triazole Formula: C27H22FN3OS MolecularWeight: 455.546483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=CC=CC=C12)OCC3=NN=C(N3C4=CC=CC=C4)SCC5=CC=C(C=C5)F

Isomeric SMILES

CC1=C(C=CC2=CC=CC=C12)OCC3=NN=C(N3C4=CC=CC=C4)SCC5=CC=C(C=C5)F

InChI

InChI=1S/C27H22FN3OS/c1-19-24-10-6-5-7-21(24)13-16-25(19)32-17-26-29-30-27(31(26)23-8-3-2-4-9-23)33-18-20-11-14-22(28)15-12-20/h2-16H,17-18H2,1H3