N-[2-(3-fluoranylpiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethyl]propane-2-sulfonamide

Systemtic Name: N-[2-(3-fluoranylpiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethyl]propane-2-sulfonamide Openeye Name: N-[2-(3-fluoropiperazin-1-yl)-2-(4-isobutylphenyl)ethyl]propane-2-sulfonamide CAS Name: N-[2-(3-fluoro-1-piperazinyl)-2-[4-(2-methylpropyl)phenyl]ethyl]-2-propanesulfonamide IUPAC Name: N-[2-(3-fluoropiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethyl]propane-2-sulfonamide Traditional Name: N-[2-(3-fluoropiperazino)-2-(4-isobutylphenyl)ethyl]propane-2-sulfonamide Formula: C19H32FN3O2S MolecularWeight: 385.539683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(CNS(=O)(=O)C(C)C)N2CCNC(C2)F

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(CNS(=O)(=O)C(C)C)N2CCNC(C2)F

InChI

InChI=1S/C19H32FN3O2S/c1-14(2)11-16-5-7-17(8-6-16)18(12-22-26(24,25)15(3)4)23-10-9-21-19(20)13-23/h5-8,14-15,18-19,21-22H,9-13H2,1-4H3