4-[4-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[oxo-[5-[3-(trifluoromethyl)phenyl]-2-furanyl]methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[5-[3-(trifluoromethyl)phenyl]furan-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[5-[3-(trifluoromethyl)phenyl]-2-furoyl]piperazino]sulfonylbenzonitrile Formula: C23H18F3N3O4S MolecularWeight: 489.46693

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H18F3N3O4S/c24-23(25,26)18-3-1-2-17(14-18)20-8-9-21(33-20)22(30)28-10-12-29(13-11-28)34(31,32)19-6-4-16(15-27)5-7-19/h1-9,14H,10-13H2