2-[4-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2,4-bis(chloranyl)-5-fluoranyl-phenyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(2,4-dichloro-5-fluoro-benzoyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(2,4-dichloro-5-fluorophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2,4-dichloro-5-fluorobenzoyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(2,4-dichloro-5-fluoro-benzoyl)piperazino]sulfonylbenzonitrile Formula: C18H14Cl2FN3O3S MolecularWeight: 442.291463

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=C(C=C2Cl)Cl)F)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=C(C=C2Cl)Cl)F)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C18H14Cl2FN3O3S/c19-14-10-15(20)16(21)9-13(14)18(25)23-5-7-24(8-6-23)28(26,27)17-4-2-1-3-12(17)11-22/h1-4,9-10H,5-8H2