3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-thiophen-2-yl-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-thiophen-2-yl-1,3,4-oxadiazole-2-thione Openeye Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-(2-thienyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-thiophen-2-yl-1,3,4-oxadiazole-2-thione IUPAC Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-thiophen-2-yl-1,3,4-oxadiazole-2-thione Traditional Name: 3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-(2-thienyl)-1,3,4-oxadiazole-2-thione Formula: C16H16N3OS2+ MolecularWeight: 330.44774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CN3C(=S)OC(=N3)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CN3C(=S)OC(=N3)C4=CC=CS4

InChI

InChI=1S/C16H15N3OS2/c21-16-19(17-15(20-16)14-6-3-9-22-14)11-18-8-7-12-4-1-2-5-13(12)10-18/h1-6,9H,7-8,10-11H2/p+1