3-[(4-fluorophenyl)methylsulfanyl]-N-[(2-phenylmethoxynaphthalen-1-yl)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-[(2-phenylmethoxynaphthalen-1-yl)methyl]-1,2,4-triazol-4-amine Openeye Name: N-[(2-benzyloxy-1-naphthyl)methyl]-3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-fluorophenyl)methylthio]-N-[(2-phenylmethoxy-1-naphthalenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-[(2-phenylmethoxynaphthalen-1-yl)methyl]-1,2,4-triazol-4-amine Traditional Name: (2-benzoxy-1-naphthyl)methyl-[3-[(4-fluorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C27H23FN4OS MolecularWeight: 470.561123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C3=CC=CC=C3C=C2)CNN4C=NN=C4SCC5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C3=CC=CC=C3C=C2)CNN4C=NN=C4SCC5=CC=C(C=C5)F

InChI

InChI=1S/C27H23FN4OS/c28-23-13-10-21(11-14-23)18-34-27-31-29-19-32(27)30-16-25-24-9-5-4-8-22(24)12-15-26(25)33-17-20-6-2-1-3-7-20/h1-15,19,30H,16-18H2