4-(4-bromophenyl)-3-piperidin-4-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-bromophenyl)-3-piperidin-4-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-bromophenyl)-3-(4-piperidyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-bromophenyl)-3-(4-piperidinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-bromophenyl)-3-piperidin-4-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-bromophenyl)-3-(4-piperidyl)-1H-1,2,4-triazole-5-thione Formula: C13H15BrN4S MolecularWeight: 339.254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NNC(=S)N2C3=CC=C(C=C3)Br

Isomeric SMILES

C1CNCCC1C2=NNC(=S)N2C3=CC=C(C=C3)Br

InChI

InChI=1S/C13H15BrN4S/c14-10-1-3-11(4-2-10)18-12(16-17-13(18)19)9-5-7-15-8-6-9/h1-4,9,15H,5-8H2,(H,17,19)