3-[(4-methoxyphenyl)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-benzyl-3-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-methoxyphenyl)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-benzyl-3-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-benzyl-3-p-anisyl-1H-1,2,4-triazole-5-thione Formula: C17H17N3OS MolecularWeight: 311.40138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NNC(=S)N2CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NNC(=S)N2CC3=CC=CC=C3

InChI

InChI=1S/C17H17N3OS/c1-21-15-9-7-13(8-10-15)11-16-18-19-17(22)20(16)12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,22)