3-azanyl-4-[[4-(2-methylpropoxy)phenyl]methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-azanyl-4-[[4-(2-methylpropoxy)phenyl]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-amino-4-[(4-isobutoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-amino-4-[[4-(2-methylpropoxy)phenyl]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-amino-4-[[4-(2-methylpropoxy)phenyl]methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-amino-4-(4-isobutoxybenzyl)-1H-1,2,4-triazole-5-thione Formula: C13H18N4OS MolecularWeight: 278.37322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CN2C(=NNC2=S)N

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CN2C(=NNC2=S)N

InChI

InChI=1S/C13H18N4OS/c1-9(2)8-18-11-5-3-10(4-6-11)7-17-12(14)15-16-13(17)19/h3-6,9H,7-8H2,1-2H3,(H2,14,15)(H,16,19)