1-(4-bromophenyl)carbonyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)isonipecotamide Formula: C21H19BrN4O2S MolecularWeight: 471.37016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NN=C(S2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NN=C(S2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN4O2S/c22-17-8-6-16(7-9-17)20(28)26-12-10-14(11-13-26)18(27)23-21-25-24-19(29-21)15-4-2-1-3-5-15/h1-9,14H,10-13H2,(H,23,25,27)