5-(2-bromophenyl)-3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(2-bromophenyl)-3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-bromophenyl)-3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-bromophenyl)-3-[2-(4-ethoxyphenoxy)ethylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-bromophenyl)-3-[2-(4-ethoxyphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-bromophenyl)-3-[2-(4-ethoxyphenoxy)ethylthio]-1H-1,2,4-triazole Formula: C18H18BrN3O2S MolecularWeight: 420.32342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NNC(=N2)C3=CC=CC=C3Br

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NNC(=N2)C3=CC=CC=C3Br

InChI

InChI=1S/C18H18BrN3O2S/c1-2-23-13-7-9-14(10-8-13)24-11-12-25-18-20-17(21-22-18)15-5-3-4-6-16(15)19/h3-10H,2,11-12H2,1H3,(H,20,21,22)