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

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-[(4-ethylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-[(4-esylpiperazino)methyl]benzamide Formula: C22H28ClN3O3S2 MolecularWeight: 482.05902

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3O3S2/c1-2-31(28,29)26-14-12-25(13-15-26)17-18-3-5-19(6-4-18)22(27)24-11-16-30-21-9-7-20(23)8-10-21/h3-10H,2,11-17H2,1H3,(H,24,27)