4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(2-methylsulfanylphenyl)benzamide

Systemtic Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(2-methylsulfanylphenyl)benzamide Openeye Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(2-methylsulfanylphenyl)benzamide CAS Name: 4-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-[2-(methylthio)phenyl]benzamide IUPAC Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-(2-methylsulfanylphenyl)benzamide Traditional Name: 4-[(4-esylpiperazino)methyl]-N-[2-(methylthio)phenyl]benzamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C21H27N3O3S2/c1-3-29(26,27)24-14-12-23(13-15-24)16-17-8-10-18(11-9-17)21(25)22-19-6-4-5-7-20(19)28-2/h4-11H,3,12-16H2,1-2H3,(H,22,25)