1-(4-fluorophenyl)-4-[(E)-5-phenylpent-1-en-3-ynyl]sulfonyl-piperazine

Systemtic Name: 1-(4-fluorophenyl)-4-[(E)-5-phenylpent-1-en-3-ynyl]sulfonyl-piperazine Openeye Name: 1-(4-fluorophenyl)-4-[(E)-5-phenylpent-1-en-3-ynyl]sulfonyl-piperazine CAS Name: 1-(4-fluorophenyl)-4-[(E)-5-phenylpent-1-en-3-ynyl]sulfonylpiperazine IUPAC Name: 1-(4-fluorophenyl)-4-[(E)-5-phenylpent-1-en-3-ynyl]sulfonylpiperazine Traditional Name: 1-(4-fluorophenyl)-4-[(E)-5-phenylpent-1-en-3-ynyl]sulfonyl-piperazine Formula: C21H21FN2O2S MolecularWeight: 384.467043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C=CC#CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)/C=C/C#CCC3=CC=CC=C3

InChI

InChI=1S/C21H21FN2O2S/c22-20-10-12-21(13-11-20)23-14-16-24(17-15-23)27(25,26)18-6-2-5-9-19-7-3-1-4-8-19/h1,3-4,6-8,10-13,18H,9,14-17H2/b18-6+