2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[4-[(3-bromophenyl)methyl]-1-piperazinyl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[4-(3-bromobenzyl)piperazino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C21H22BrN5OS MolecularWeight: 472.40128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Br)CC(=O)NC3=NN=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Br)CC(=O)NC3=NN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C21H22BrN5OS/c22-18-8-4-5-16(13-18)14-26-9-11-27(12-10-26)15-19(28)23-21-25-24-20(29-21)17-6-2-1-3-7-17/h1-8,13H,9-12,14-15H2,(H,23,25,28)