3-(2-fluorophenyl)-5-(naphthalen-1-ylmethylsulfanyl)-4-phenethyl-1,2,4-triazole

Systemtic Name: 3-(2-fluorophenyl)-5-(naphthalen-1-ylmethylsulfanyl)-4-phenethyl-1,2,4-triazole Openeye Name: 3-(2-fluorophenyl)-5-(1-naphthylmethylsulfanyl)-4-phenethyl-1,2,4-triazole CAS Name: 3-(2-fluorophenyl)-5-(1-naphthalenylmethylthio)-4-phenethyl-1,2,4-triazole IUPAC Name: 3-(2-fluorophenyl)-5-(naphthalen-1-ylmethylsulfanyl)-4-phenethyl-1,2,4-triazole Traditional Name: 3-(2-fluorophenyl)-5-(1-naphthylmethylthio)-4-phenethyl-1,2,4-triazole Formula: C27H22FN3S MolecularWeight: 439.547083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5F

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=CC=C5F

InChI

InChI=1S/C27H22FN3S/c28-25-16-7-6-15-24(25)26-29-30-27(31(26)18-17-20-9-2-1-3-10-20)32-19-22-13-8-12-21-11-4-5-14-23(21)22/h1-16H,17-19H2