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

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-4-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]ethyl]-4-[(4-mesylpiperazino)methyl]benzamide Formula: C22H28ClN3O3S2 MolecularWeight: 482.05902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O3S2/c1-31(28,29)26-13-11-25(12-14-26)16-18-2-6-20(7-3-18)22(27)24-10-15-30-17-19-4-8-21(23)9-5-19/h2-9H,10-17H2,1H3,(H,24,27)