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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCNN2C=NN=C2SCC3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CNN2C=NN=C2SCC3=CC=CC=C3F

InChI

InChI=1S/C18H17FN4S/c19-17-11-5-4-10-16(17)13-24-18-22-20-14-23(18)21-12-6-9-15-7-2-1-3-8-15/h1-11,14,21H,12-13H2/b9-6+