3-[(4-fluorophenyl)methylsulfanyl]-N-(3-phenylprop-2-enyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-(3-phenylprop-2-enyl)-1,2,4-triazol-4-amine Openeye Name: N-cinnamyl-3-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-fluorophenyl)methylthio]-N-(3-phenylprop-2-enyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-fluorophenyl)methylsulfanyl]-N-(3-phenylprop-2-enyl)-1,2,4-triazol-4-amine Traditional Name: cinnamyl-[3-[(4-fluorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C18H17FN4S MolecularWeight: 340.417783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCNN2C=NN=C2SCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)C=CCNN2C=NN=C2SCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FN4S/c19-17-10-8-16(9-11-17)13-24-18-22-20-14-23(18)21-12-4-7-15-5-2-1-3-6-15/h1-11,14,21H,12-13H2