3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine CAS Name: 3-[2-(3-bromophenoxy)ethylthio]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-[2-(3-bromophenoxy)ethylthio]-5-p-anisyl-1,2,4-triazol-4-yl]amine Formula: C18H19BrN4O2S MolecularWeight: 435.33806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCCOC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H19BrN4O2S/c1-24-15-7-5-13(6-8-15)11-17-21-22-18(23(17)20)26-10-9-25-16-4-2-3-14(19)12-16/h2-8,12H,9-11,20H2,1H3