4-(2,3-dimethylphenyl)-3-[(4-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2,3-dimethylphenyl)-3-[(4-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,3-dimethylphenyl)-3-[(4-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,3-dimethylphenyl)-3-[(4-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,3-dimethylphenyl)-3-[(4-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2,3-dimethylphenyl)-3-[(4-methoxyphenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C18H19N3O2S MolecularWeight: 341.42736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=NNC2=S)COC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=NNC2=S)COC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C18H19N3O2S/c1-12-5-4-6-16(13(12)2)21-17(19-20-18(21)24)11-23-15-9-7-14(22-3)8-10-15/h4-10H,11H2,1-3H3,(H,20,24)