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

Systemtic Name: 3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[2-(phenylmethylsulfanyl)ethyl]benzamide Openeye Name: N-(2-benzylsulfanylethyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: 3-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-[2-(phenylmethylthio)ethyl]benzamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[2-(benzylthio)ethyl]-3-[(4-esylpiperazino)methyl]benzamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3S2/c1-2-31(28,29)26-14-12-25(13-15-26)18-21-9-6-10-22(17-21)23(27)24-11-16-30-19-20-7-4-3-5-8-20/h3-10,17H,2,11-16,18-19H2,1H3,(H,24,27)