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5-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

5-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name:5-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile
Openeye Name:5-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazin-1-yl]-2-isopropyl-2-phenyl-pentanenitrile
CAS Name:5-[4-[2-[(4-fluorophenyl)thio]ethyl]-1-piperazinyl]-2-phenyl-2-propan-2-ylpentanenitrile
IUPAC Name:5-[4-[2-(4-fluorophenyl)sulfanylethyl]piperazin-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile
Traditional Name:5-[4-[2-[(4-fluorophenyl)thio]ethyl]piperazino]-2-isopropyl-2-phenyl-valeronitrile
Formula: C26H34FN3S
MolecularWeight: 439.631663
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCSC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3


Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCSC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3


InChI

InChI=1S/C26H34FN3S/c1-22(2)26(21-28,23-7-4-3-5-8-23)13-6-14-29-15-17-30(18-16-29)19-20-31-25-11-9-24(27)10-12-25/h3-5,7-12,22H,6,13-20H2,1-2H3


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