4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonyl-N-cyclohexyl-N-methyl-benzenesulfonamide

Systemtic Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonyl-N-cyclohexyl-N-methyl-benzenesulfonamide Openeye Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonyl-N-cyclohexyl-N-methyl-benzenesulfonamide CAS Name: 4-[[4-(2-cyanoethyl)-1-piperazinyl]sulfonyl]-N-cyclohexyl-N-methylbenzenesulfonamide IUPAC Name: 4-[4-(2-cyanoethyl)piperazin-1-yl]sulfonyl-N-cyclohexyl-N-methylbenzenesulfonamide Traditional Name: 4-[4-(2-cyanoethyl)piperazino]sulfonyl-N-cyclohexyl-N-methyl-benzenesulfonamide Formula: C20H30N4O4S2 MolecularWeight: 454.6066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CCC#N

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)CCC#N

InChI

InChI=1S/C20H30N4O4S2/c1-22(18-6-3-2-4-7-18)29(25,26)19-8-10-20(11-9-19)30(27,28)24-16-14-23(15-17-24)13-5-12-21/h8-11,18H,2-7,13-17H2,1H3