1-(4-fluorophenyl)-4-[(E)-4-phenylbut-1-en-3-ynyl]sulfonyl-piperazine

Systemtic Name: 1-(4-fluorophenyl)-4-[(E)-4-phenylbut-1-en-3-ynyl]sulfonyl-piperazine Openeye Name: 1-(4-fluorophenyl)-4-[(E)-4-phenylbut-1-en-3-ynyl]sulfonyl-piperazine CAS Name: 1-(4-fluorophenyl)-4-[(E)-4-phenylbut-1-en-3-ynyl]sulfonylpiperazine IUPAC Name: 1-(4-fluorophenyl)-4-[(E)-4-phenylbut-1-en-3-ynyl]sulfonylpiperazine Traditional Name: 1-(4-fluorophenyl)-4-[(E)-4-phenylbut-1-en-3-ynyl]sulfonyl-piperazine Formula: C20H19FN2O2S MolecularWeight: 370.440463

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C=CC#CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)/C=C/C#CC3=CC=CC=C3

InChI

InChI=1S/C20H19FN2O2S/c21-19-9-11-20(12-10-19)22-13-15-23(16-14-22)26(24,25)17-5-4-8-18-6-2-1-3-7-18/h1-3,5-7,9-12,17H,13-16H2/b17-5+