2-[(4-chlorophenyl)methylsulfanyl]-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]acetamide CAS Name: 2-[(4-chlorophenyl)methylthio]-N-[3-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-[3-(4-ethylpiperazin-1-yl)sulfonylphenyl]acetamide Traditional Name: 2-[(4-chlorobenzyl)thio]-N-[3-(4-ethylpiperazino)sulfonylphenyl]acetamide Formula: C21H26ClN3O3S2 MolecularWeight: 468.03244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCC3=CC=C(C=C3)Cl

InChI

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