3-[(3-fluorophenyl)methylsulfanyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole

Systemtic Name: 3-[(3-fluorophenyl)methylsulfanyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole Openeye Name: 3-[(3-fluorophenyl)methylsulfanyl]-5-[(E)-styryl]-1H-1,2,4-triazole CAS Name: 3-[(3-fluorophenyl)methylthio]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole IUPAC Name: 3-[(3-fluorophenyl)methylsulfanyl]-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole Traditional Name: 3-[(3-fluorobenzyl)thio]-5-[(E)-styryl]-1H-1,2,4-triazole Formula: C17H14FN3S MolecularWeight: 311.376563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=NC(=NN2)SCC3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=NC(=NN2)SCC3=CC(=CC=C3)F

InChI

InChI=1S/C17H14FN3S/c18-15-8-4-7-14(11-15)12-22-17-19-16(20-21-17)10-9-13-5-2-1-3-6-13/h1-11H,12H2,(H,19,20,21)/b10-9+