3-[(4-methylphenoxy)methyl]-4-(2-methylprop-2-enyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-methylphenoxy)methyl]-4-(2-methylprop-2-enyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-methylallyl)-3-[(4-methylphenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-methylphenoxy)methyl]-4-(2-methylprop-2-enyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-methylphenoxy)methyl]-4-(2-methylprop-2-enyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-methylallyl)-3-[(4-methylphenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C14H17N3OS MolecularWeight: 275.36928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NNC(=S)N2CC(=C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NNC(=S)N2CC(=C)C

InChI

InChI=1S/C14H17N3OS/c1-10(2)8-17-13(15-16-14(17)19)9-18-12-6-4-11(3)5-7-12/h4-7H,1,8-9H2,2-3H3,(H,16,19)