4-phenyl-1-[4-[1-[3-(trifluoromethyl)phenyl]sulfonylindol-3-yl]butanoyl]piperidine-4-carbonitrile

Systemtic Name: 4-phenyl-1-[4-[1-[3-(trifluoromethyl)phenyl]sulfonylindol-3-yl]butanoyl]piperidine-4-carbonitrile Openeye Name: 4-phenyl-1-[4-[1-[3-(trifluoromethyl)phenyl]sulfonylindol-3-yl]butanoyl]piperidine-4-carbonitrile CAS Name: 1-[1-oxo-4-[1-[3-(trifluoromethyl)phenyl]sulfonyl-3-indolyl]butyl]-4-phenyl-4-piperidinecarbonitrile IUPAC Name: 4-phenyl-1-[4-[1-[3-(trifluoromethyl)phenyl]sulfonylindol-3-yl]butanoyl]piperidine-4-carbonitrile Traditional Name: 4-phenyl-1-[4-[1-[3-(trifluoromethyl)phenyl]sulfonylindol-3-yl]butanoyl]isonipecotonitrile Formula: C31H28F3N3O3S MolecularWeight: 579.63253

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC=CC=C2)C(=O)CCCC3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC=CC=C2)C(=O)CCCC3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C31H28F3N3O3S/c32-31(33,34)25-11-7-12-26(20-25)41(39,40)37-21-23(27-13-4-5-14-28(27)37)8-6-15-29(38)36-18-16-30(22-35,17-19-36)24-9-2-1-3-10-24/h1-5,7,9-14,20-21H,6,8,15-19H2