3-(methoxymethyl)-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(methoxymethyl)-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-isopropylphenyl)-3-(methoxymethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(methoxymethyl)-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(methoxymethyl)-4-(4-propan-2-ylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(methoxymethyl)-4-p-cumenyl-1H-1,2,4-triazole-5-thione Formula: C13H17N3OS MolecularWeight: 263.35858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=NNC2=S)COC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=NNC2=S)COC

InChI

InChI=1S/C13H17N3OS/c1-9(2)10-4-6-11(7-5-10)16-12(8-17-3)14-15-13(16)18/h4-7,9H,8H2,1-3H3,(H,15,18)