4-(2-methoxyethyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-methoxyethyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzyl-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methoxyethyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzyl-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-benzyl-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione Formula: C12H15N3OS MolecularWeight: 249.332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NNC1=S)CC2=CC=CC=C2

Isomeric SMILES

COCCN1C(=NNC1=S)CC2=CC=CC=C2

InChI

InChI=1S/C12H15N3OS/c1-16-8-7-15-11(13-14-12(15)17)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,14,17)