3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]benzamide

Systemtic Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]benzamide Openeye Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]benzamide CAS Name: 3-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-[3-[(4-fluorophenyl)methylthio]propyl]benzamide IUPAC Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]benzamide Traditional Name: 3-[(4-esylpiperazino)methyl]-N-[3-[(4-fluorobenzyl)thio]propyl]benzamide Formula: C24H32FN3O3S2 MolecularWeight: 493.657583

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NCCCSCC3=CC=C(C=C3)F

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NCCCSCC3=CC=C(C=C3)F

InChI

InChI=1S/C24H32FN3O3S2/c1-2-33(30,31)28-14-12-27(13-15-28)18-21-5-3-6-22(17-21)24(29)26-11-4-16-32-19-20-7-9-23(25)10-8-20/h3,5-10,17H,2,4,11-16,18-19H2,1H3,(H,26,29)