N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[2-[(3-chlorophenyl)methylthio]ethyl]-4-[(4-ethylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[2-[(3-chlorobenzyl)thio]ethyl]-4-[(4-esylpiperazino)methyl]benzamide Formula: C23H30ClN3O3S2 MolecularWeight: 496.0856

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC(=CC=C3)Cl

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H30ClN3O3S2/c1-2-32(29,30)27-13-11-26(12-14-27)17-19-6-8-21(9-7-19)23(28)25-10-15-31-18-20-4-3-5-22(24)16-20/h3-9,16H,2,10-15,17-18H2,1H3,(H,25,28)