3-[(4-bromophenyl)methylsulfanyl]-5-[(2-methoxy-4-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazole

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(2-methoxy-4-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(2-methoxy-4-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-5-[(2-methoxy-4-methylphenoxy)methyl]-4-methyl-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(2-methoxy-4-methylphenoxy)methyl]-4-methyl-1,2,4-triazole Traditional Name: 3-[(4-bromobenzyl)thio]-5-[(2-methoxy-4-methyl-phenoxy)methyl]-4-methyl-1,2,4-triazole Formula: C19H20BrN3O2S MolecularWeight: 434.35

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NN=C(N2C)SCC3=CC=C(C=C3)Br)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NN=C(N2C)SCC3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C19H20BrN3O2S/c1-13-4-9-16(17(10-13)24-3)25-11-18-21-22-19(23(18)2)26-12-14-5-7-15(20)8-6-14/h4-10H,11-12H2,1-3H3