3-(4-fluorophenyl)sulfanyl-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfanyl-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]propanamide Openeye Name: 3-(4-fluorophenyl)sulfanyl-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]propanamide CAS Name: 3-[(4-fluorophenyl)thio]-N-[[2-[(4-phenyl-1-piperazinyl)methyl]phenyl]methyl]propanamide IUPAC Name: 3-(4-fluorophenyl)sulfanyl-N-[[2-[(4-phenylpiperazin-1-yl)methyl]phenyl]methyl]propanamide Traditional Name: 3-[(4-fluorophenyl)thio]-N-[2-[(4-phenylpiperazino)methyl]benzyl]propionamide Formula: C27H30FN3OS MolecularWeight: 463.610003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2CNC(=O)CCSC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2CNC(=O)CCSC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C27H30FN3OS/c28-24-10-12-26(13-11-24)33-19-14-27(32)29-20-22-6-4-5-7-23(22)21-30-15-17-31(18-16-30)25-8-2-1-3-9-25/h1-13H,14-21H2,(H,29,32)