2-[4-(5-bromanylpyridin-3-yl)carbonylpiperazin-1-yl]-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[4-(5-bromanylpyridin-3-yl)carbonylpiperazin-1-yl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]-1-(2-thienyl)ethanone CAS Name: 2-[4-[(5-bromo-3-pyridinyl)-oxomethyl]-1-piperazinyl]-1-thiophen-2-ylethanone IUPAC Name: 2-[4-(5-bromopyridine-3-carbonyl)piperazin-1-yl]-1-thiophen-2-ylethanone Traditional Name: 2-[4-(5-bromonicotinoyl)piperazino]-1-(2-thienyl)ethanone Formula: C16H16BrN3O2S MolecularWeight: 394.28614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H16BrN3O2S/c17-13-8-12(9-18-10-13)16(22)20-5-3-19(4-6-20)11-14(21)15-2-1-7-23-15/h1-2,7-10H,3-6,11H2