4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]benzamide

Systemtic Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]benzamide Openeye Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]benzamide CAS Name: 4-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-[3-[(2-fluorophenyl)methylthio]propyl]benzamide IUPAC Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]benzamide Traditional Name: 4-[(4-esylpiperazino)methyl]-N-[3-[(2-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=C(C=C2)C(=O)NCCCSCC3=CC=CC=C3F

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NCCCSCC3=CC=CC=C3F

InChI

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