2-[4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]piperazin-1-yl]benzonitrile CAS Name: 2-[4-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-(5-bromo-6-chloropyridin-3-yl)sulfonylpiperazin-1-yl]benzonitrile Traditional Name: 2-[4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]piperazino]benzonitrile Formula: C16H14BrClN4O2S MolecularWeight: 441.72996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2C#N)S(=O)(=O)C3=CC(=C(N=C3)Cl)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2C#N)S(=O)(=O)C3=CC(=C(N=C3)Cl)Br

InChI

InChI=1S/C16H14BrClN4O2S/c17-14-9-13(11-20-16(14)18)25(23,24)22-7-5-21(6-8-22)15-4-2-1-3-12(15)10-19/h1-4,9,11H,5-8H2