2-(azocan-1-ylmethyl)-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-(azocan-1-ylmethyl)-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Openeye Name: 2-(azocan-1-ylmethyl)-5-(2-thienyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-(1-azocanylmethyl)-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione IUPAC Name: 2-(azocan-1-ylmethyl)-5-thiophen-2-yl-1H-1,2,4-triazole-3-thione Traditional Name: 2-(azocan-1-ylmethyl)-5-(2-thienyl)-1H-1,2,4-triazole-3-thione Formula: C14H20N4S2 MolecularWeight: 308.4654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CN2C(=S)N=C(N2)C3=CC=CS3

Isomeric SMILES

C1CCCN(CCC1)CN2C(=S)N=C(N2)C3=CC=CS3

InChI

InChI=1S/C14H20N4S2/c19-14-15-13(12-7-6-10-20-12)16-18(14)11-17-8-4-2-1-3-5-9-17/h6-7,10H,1-5,8-9,11H2,(H,15,16,19)