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

Systemtic Name: 3-(4-ethoxyphenyl)-4-(2-fluorophenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(4-ethoxyphenyl)-4-(2-fluorophenyl)-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(4-ethoxyphenyl)-4-(2-fluorophenyl)-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 3-(4-ethoxyphenyl)-4-(2-fluorophenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 4-(2-fluorophenyl)-3-(1-naphthylmethylthio)-5-p-phenetyl-1,2,4-triazole Formula: C27H22FN3OS MolecularWeight: 455.546483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3F)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3F)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H22FN3OS/c1-2-32-22-16-14-20(15-17-22)26-29-30-27(31(26)25-13-6-5-12-24(25)28)33-18-21-10-7-9-19-8-3-4-11-23(19)21/h3-17H,2,18H2,1H3