1-[(2-bromophenyl)methyl]-N-[1-(phenylmethyl)piperidin-4-yl]-5-propyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[(2-bromophenyl)methyl]-N-[1-(phenylmethyl)piperidin-4-yl]-5-propyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-1-[(2-bromophenyl)methyl]-5-propyl-triazole-4-carboxamide CAS Name: 1-[(2-bromophenyl)methyl]-N-[1-(phenylmethyl)-4-piperidinyl]-5-propyl-4-triazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-1-[(2-bromophenyl)methyl]-5-propyltriazole-4-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-1-(2-bromobenzyl)-5-propyl-triazole-4-carboxamide Formula: C25H30BrN5O MolecularWeight: 496.4426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=NN1CC2=CC=CC=C2Br)C(=O)NC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCC1=C(N=NN1CC2=CC=CC=C2Br)C(=O)NC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H30BrN5O/c1-2-8-23-24(28-29-31(23)18-20-11-6-7-12-22(20)26)25(32)27-21-13-15-30(16-14-21)17-19-9-4-3-5-10-19/h3-7,9-12,21H,2,8,13-18H2,1H3,(H,27,32)