3-[(4-bromanylphenoxy)methyl]-5-(2-methylprop-2-enylsulfanyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-[(4-bromanylphenoxy)methyl]-5-(2-methylprop-2-enylsulfanyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-[(4-bromophenoxy)methyl]-5-(2-methylallylsulfanyl)-4-phenyl-1,2,4-triazole CAS Name: 3-[(4-bromophenoxy)methyl]-5-(2-methylprop-2-enylthio)-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(4-bromophenoxy)methyl]-5-(2-methylprop-2-enylsulfanyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-[(4-bromophenoxy)methyl]-5-(2-methylallylthio)-4-phenyl-1,2,4-triazole Formula: C19H18BrN3OS MolecularWeight: 416.33472

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NN=C(N1C2=CC=CC=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=C)CSC1=NN=C(N1C2=CC=CC=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrN3OS/c1-14(2)13-25-19-22-21-18(23(19)16-6-4-3-5-7-16)12-24-17-10-8-15(20)9-11-17/h3-11H,1,12-13H2,2H3