2-chloranyl-6-[4-(4-pyridin-4-ylpiperazin-1-yl)sulfonylphenoxy]benzenecarbonitrile

Systemtic Name: 2-chloranyl-6-[4-(4-pyridin-4-ylpiperazin-1-yl)sulfonylphenoxy]benzenecarbonitrile Openeye Name: 2-chloro-6-[4-[4-(4-pyridyl)piperazin-1-yl]sulfonylphenoxy]benzonitrile CAS Name: 2-chloro-6-[4-[(4-pyridin-4-yl-1-piperazinyl)sulfonyl]phenoxy]benzonitrile IUPAC Name: 2-chloro-6-[4-(4-pyridin-4-ylpiperazin-1-yl)sulfonylphenoxy]benzonitrile Traditional Name: 2-chloro-6-[4-[4-(4-pyridyl)piperazino]sulfonylphenoxy]benzonitrile Formula: C22H19ClN4O3S MolecularWeight: 454.92926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=C(C(=CC=C4)Cl)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=C(C(=CC=C4)Cl)C#N

InChI

InChI=1S/C22H19ClN4O3S/c23-21-2-1-3-22(20(21)16-24)30-18-4-6-19(7-5-18)31(28,29)27-14-12-26(13-15-27)17-8-10-25-11-9-17/h1-11H,12-15H2