2-[(4-chlorophenyl)methylsulfanyl]-1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[(4-chlorophenyl)methylthio]-1-[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-piperazinyl]ethanone IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(4-chlorobenzyl)thio]-1-[4-(4-methylpiperazino)sulfonylpiperazino]ethanone Formula: C18H27ClN4O3S2 MolecularWeight: 447.01498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)CSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H27ClN4O3S2/c1-20-6-10-22(11-7-20)28(25,26)23-12-8-21(9-13-23)18(24)15-27-14-16-2-4-17(19)5-3-16/h2-5H,6-15H2,1H3