N-chloranyl-3-(2-cyanophenyl)-N-[4-(1-ethylpiperazin-2-yl)phenyl]propane-1-sulfonamide

Systemtic Name: N-chloranyl-3-(2-cyanophenyl)-N-[4-(1-ethylpiperazin-2-yl)phenyl]propane-1-sulfonamide Openeye Name: N-chloro-3-(2-cyanophenyl)-N-[4-(1-ethylpiperazin-2-yl)phenyl]propane-1-sulfonamide CAS Name: N-chloro-3-(2-cyanophenyl)-N-[4-(1-ethyl-2-piperazinyl)phenyl]-1-propanesulfonamide IUPAC Name: N-chloro-3-(2-cyanophenyl)-N-[4-(1-ethylpiperazin-2-yl)phenyl]propane-1-sulfonamide Traditional Name: N-chloro-3-(2-cyanophenyl)-N-[4-(1-ethylpiperazin-2-yl)phenyl]propane-1-sulfonamide Formula: C22H27ClN4O2S MolecularWeight: 446.99338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCNCC1C2=CC=C(C=C2)N(S(=O)(=O)CCCC3=CC=CC=C3C#N)Cl

Isomeric SMILES

CCN1CCNCC1C2=CC=C(C=C2)N(S(=O)(=O)CCCC3=CC=CC=C3C#N)Cl

InChI

InChI=1S/C22H27ClN4O2S/c1-2-26-14-13-25-17-22(26)19-9-11-21(12-10-19)27(23)30(28,29)15-5-8-18-6-3-4-7-20(18)16-24/h3-4,6-7,9-12,22,25H,2,5,8,13-15,17H2,1H3