N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2-ethylsulfanyl-benzamide

Systemtic Name: N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2-ethylsulfanyl-benzamide Openeye Name: N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2-ethylsulfanyl-benzamide CAS Name: N-[2-[[4-(4-chlorophenyl)-1-piperazinyl]sulfonyl]ethyl]-2-(ethylthio)benzamide IUPAC Name: N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]-2-ethylsulfanylbenzamide Traditional Name: N-[2-[4-(4-chlorophenyl)piperazino]sulfonylethyl]-2-(ethylthio)benzamide Formula: C21H26ClN3O3S2 MolecularWeight: 468.03244

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NCCS(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN3O3S2/c1-2-29-20-6-4-3-5-19(20)21(26)23-11-16-30(27,28)25-14-12-24(13-15-25)18-9-7-17(22)8-10-18/h3-10H,2,11-16H2,1H3,(H,23,26)