(5-bromanylpyridin-3-yl)-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (5-bromanylpyridin-3-yl)-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]methanone Openeye Name: (5-bromo-3-pyridyl)-[4-[(5-phenyl-2-thienyl)methyl]piperazin-1-yl]methanone CAS Name: (5-bromo-3-pyridinyl)-[4-[(5-phenyl-2-thiophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (5-bromopyridin-3-yl)-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]methanone Traditional Name: (5-bromo-3-pyridyl)-[4-[(5-phenyl-2-thienyl)methyl]piperazino]methanone Formula: C21H20BrN3OS MolecularWeight: 442.372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)C3=CC=CC=C3)C(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)C3=CC=CC=C3)C(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C21H20BrN3OS/c22-18-12-17(13-23-14-18)21(26)25-10-8-24(9-11-25)15-19-6-7-20(27-19)16-4-2-1-3-5-16/h1-7,12-14H,8-11,15H2