[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(5-bromanylpyridin-3-yl)methanone

Systemtic Name: [4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(5-bromanylpyridin-3-yl)methanone Openeye Name: [4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-(5-bromo-3-pyridyl)methanone CAS Name: [4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-(5-bromo-3-pyridinyl)methanone IUPAC Name: [4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-(5-bromopyridin-3-yl)methanone Traditional Name: [4-(benzothiophen-3-ylmethyl)piperazino]-(5-bromo-3-pyridyl)methanone Formula: C19H18BrN3OS MolecularWeight: 416.33472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC3=CC=CC=C32)C(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CSC3=CC=CC=C32)C(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C19H18BrN3OS/c20-16-9-14(10-21-11-16)19(24)23-7-5-22(6-8-23)12-15-13-25-18-4-2-1-3-17(15)18/h1-4,9-11,13H,5-8,12H2