3-[5-[(4-bromanylphenoxy)methyl]furan-2-yl]-4-(3-methoxypropyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[5-[(4-bromanylphenoxy)methyl]furan-2-yl]-4-(3-methoxypropyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[5-[(4-bromophenoxy)methyl]-2-furyl]-4-(3-methoxypropyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[5-[(4-bromophenoxy)methyl]-2-furanyl]-4-(3-methoxypropyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[5-[(4-bromophenoxy)methyl]furan-2-yl]-4-(3-methoxypropyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[5-[(4-bromophenoxy)methyl]-2-furyl]-4-(3-methoxypropyl)-1H-1,2,4-triazole-5-thione Formula: C17H18BrN3O3S MolecularWeight: 424.31212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NNC1=S)C2=CC=C(O2)COC3=CC=C(C=C3)Br

Isomeric SMILES

COCCCN1C(=NNC1=S)C2=CC=C(O2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H18BrN3O3S/c1-22-10-2-9-21-16(19-20-17(21)25)15-8-7-14(24-15)11-23-13-5-3-12(18)4-6-13/h3-8H,2,9-11H2,1H3,(H,20,25)