N-(3-bromophenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide

Systemtic Name: N-(3-bromophenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Openeye Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-bromophenyl)piperazine-1-carboxamide CAS Name: N-(3-bromophenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinecarboxamide IUPAC Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-bromophenyl)piperazine-1-carboxamide Traditional Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-bromophenyl)piperazine-1-carboxamide Formula: C20H20BrN5OS MolecularWeight: 458.3747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C20H20BrN5OS/c21-16-7-4-8-17(14-16)22-19(27)25-9-11-26(12-10-25)20-23-18(24-28-20)13-15-5-2-1-3-6-15/h1-8,14H,9-13H2,(H,22,27)