N-(2-cyanoethyl)-4-[4-(2-morpholin-4-ylethanoyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-[4-(2-morpholin-4-ylethanoyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-4-[4-(2-morpholinoacetyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-[[4-[2-(4-morpholinyl)-1-oxoethyl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-[4-(2-morpholin-4-ylacetyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-(2-cyanoethyl)-4-[4-(2-morpholinoacetyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C20H27N5O5S MolecularWeight: 449.52388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2CCOCC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N

Isomeric SMILES

C1CN(CCN1C(=O)CN2CCOCC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N

InChI

InChI=1S/C20H27N5O5S/c21-6-1-7-22-31(28,29)18-4-2-17(3-5-18)20(27)25-10-8-24(9-11-25)19(26)16-23-12-14-30-15-13-23/h2-5,22H,1,7-16H2