5-(2-bromophenyl)-3-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(2-bromophenyl)-3-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 3-[(4-benzyl-1-piperidyl)methyl]-5-(2-bromophenyl)-1,3,4-oxadiazole-2-thione CAS Name: 5-(2-bromophenyl)-3-[[4-(phenylmethyl)-1-piperidinyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[(4-benzylpiperidin-1-yl)methyl]-5-(2-bromophenyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-[(4-benzylpiperidino)methyl]-5-(2-bromophenyl)-1,3,4-oxadiazole-2-thione Formula: C21H22BrN3OS MolecularWeight: 444.38788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CN3C(=S)OC(=N3)C4=CC=CC=C4Br

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CN3C(=S)OC(=N3)C4=CC=CC=C4Br

InChI

InChI=1S/C21H22BrN3OS/c22-19-9-5-4-8-18(19)20-23-25(21(27)26-20)15-24-12-10-17(11-13-24)14-16-6-2-1-3-7-16/h1-9,17H,10-15H2