3-(4,5-dihydrobenzo[g][1]benzothiol-2-yl)-4-ethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(4,5-dihydrobenzo[g][1]benzothiol-2-yl)-4-ethyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4,5-dihydrobenzo[g]benzothiophen-2-yl)-4-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(4,5-dihydrobenzo[g][1]benzothiol-2-yl)-4-ethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4,5-dihydrobenzo[g][1]benzothiol-2-yl)-4-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4,5-dihydrobenzo[g]benzothiophen-2-yl)-4-ethyl-1H-1,2,4-triazole-5-thione Formula: C16H15N3S2 MolecularWeight: 313.4404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)C2=CC3=C(S2)C4=CC=CC=C4CC3

Isomeric SMILES

CCN1C(=NNC1=S)C2=CC3=C(S2)C4=CC=CC=C4CC3

InChI

InChI=1S/C16H15N3S2/c1-2-19-15(17-18-16(19)20)13-9-11-8-7-10-5-3-4-6-12(10)14(11)21-13/h3-6,9H,2,7-8H2,1H3,(H,18,20)