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

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-[(2-phenylmethoxyphenyl)methyl]-1,2,4-triazol-4-amine Openeye Name: N-[(2-benzyloxyphenyl)methyl]-3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-fluorophenyl)methylthio]-N-[(2-phenylmethoxyphenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-[(2-phenylmethoxyphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: (2-benzoxybenzyl)-[3-[(4-fluorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C23H21FN4OS MolecularWeight: 420.502443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2CNN3C=NN=C3SCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2CNN3C=NN=C3SCC4=CC=C(C=C4)F

InChI

InChI=1S/C23H21FN4OS/c24-21-12-10-19(11-13-21)16-30-23-27-25-17-28(23)26-14-20-8-4-5-9-22(20)29-15-18-6-2-1-3-7-18/h1-13,17,26H,14-16H2