3-(1-benzothiophen-3-yl)-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(1-benzothiophen-3-yl)-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(benzothiophen-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(1-benzothiophen-3-yl)-4-(2-oxolanylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(1-benzothiophen-3-yl)-4-(oxolan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(benzothiophen-3-yl)-4-(tetrahydrofurfuryl)-1H-1,2,4-triazole-5-thione Formula: C15H15N3OS2 MolecularWeight: 317.4291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NNC2=S)C3=CSC4=CC=CC=C43

Isomeric SMILES

C1CC(OC1)CN2C(=NNC2=S)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C15H15N3OS2/c20-15-17-16-14(18(15)8-10-4-3-7-19-10)12-9-21-13-6-2-1-5-11(12)13/h1-2,5-6,9-10H,3-4,7-8H2,(H,17,20)