5-(2-fluorophenyl)-3-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(2-fluorophenyl)-3-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-1,2,4-triazole Openeye Name: 3-[(E)-cinnamyl]sulfanyl-5-(2-fluorophenyl)-1H-1,2,4-triazole CAS Name: 5-(2-fluorophenyl)-3-[[(E)-3-phenylprop-2-enyl]thio]-1H-1,2,4-triazole IUPAC Name: 5-(2-fluorophenyl)-3-[(E)-3-phenylprop-2-enyl]sulfanyl-1H-1,2,4-triazole Traditional Name: 3-[[(E)-cinnamyl]thio]-5-(2-fluorophenyl)-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=CCSC2=NNC(=N2)C3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CSC2=NNC(=N2)C3=CC=CC=C3F

InChI

InChI=1S/C17H14FN3S/c18-15-11-5-4-10-14(15)16-19-17(21-20-16)22-12-6-9-13-7-2-1-3-8-13/h1-11H,12H2,(H,19,20,21)/b9-6+