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

Systemtic Name: 2-[4-(4-chloranyl-2-fluoranyl-phenyl)sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(4-chloro-2-fluoro-phenyl)sulfonylpiperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(4-chloro-2-fluorophenyl)sulfonyl-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(4-chloro-2-fluorophenyl)sulfonylpiperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(4-chloro-2-fluoro-phenyl)sulfonylpiperazino]sulfonylbenzonitrile Formula: C17H15ClFN3O4S2 MolecularWeight: 443.900103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1S(=O)(=O)C2=C(C=C(C=C2)Cl)F)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1S(=O)(=O)C2=C(C=C(C=C2)Cl)F)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C17H15ClFN3O4S2/c18-14-5-6-17(15(19)11-14)28(25,26)22-9-7-21(8-10-22)27(23,24)16-4-2-1-3-13(16)12-20/h1-6,11H,7-10H2