4-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-1H-1,2,4-triazole-5-thione Formula: C13H18N4OS MolecularWeight: 278.37322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CN1C=NNC1=S)C2=CC(=CC=C2)OC

Isomeric SMILES

CN(C)C(CN1C=NNC1=S)C2=CC(=CC=C2)OC

InChI

InChI=1S/C13H18N4OS/c1-16(2)12(8-17-9-14-15-13(17)19)10-5-4-6-11(7-10)18-3/h4-7,9,12H,8H2,1-3H3,(H,15,19)