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

Systemtic Name: 2-[4-(2-chloranyl-4-fluoranyl-phenyl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(2-chloro-4-fluoro-benzoyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[(2-chloro-4-fluorophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2-chloro-4-fluorobenzoyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(2-chloro-4-fluoro-benzoyl)piperazino]sulfonylbenzonitrile Formula: C18H15ClFN3O3S MolecularWeight: 407.846403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClFN3O3S/c19-16-11-14(20)5-6-15(16)18(24)22-7-9-23(10-8-22)27(25,26)17-4-2-1-3-13(17)12-21/h1-6,11H,7-10H2