3-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(5-fluoro-2-methoxy-phenyl)methylsulfanyl]-5-phenyl-1,2,4-triazole CAS Name: 3-[(5-fluoro-2-methoxyphenyl)methylthio]-5-phenyl-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(5-fluoro-2-methoxyphenyl)methylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(5-fluoro-2-methoxy-benzyl)thio]-5-phenyl-1,2,4-triazole Formula: C19H18FN3OS MolecularWeight: 355.429123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CSC2=NN=C(N2CC=C)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)F)CSC2=NN=C(N2CC=C)C3=CC=CC=C3

InChI

InChI=1S/C19H18FN3OS/c1-3-11-23-18(14-7-5-4-6-8-14)21-22-19(23)25-13-15-12-16(20)9-10-17(15)24-2/h3-10,12H,1,11,13H2,2H3