2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-fluorophenyl)propanamide

Systemtic Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-fluorophenyl)propanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-fluorophenyl)propanamide CAS Name: 2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(3-fluorophenyl)propanamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-fluorophenyl)propanamide Traditional Name: 2-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-N-(3-fluorophenyl)propionamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C21H26FN3O3S/c1-15-7-8-16(2)20(13-15)29(27,28)25-11-9-24(10-12-25)17(3)21(26)23-19-6-4-5-18(22)14-19/h4-8,13-14,17H,9-12H2,1-3H3,(H,23,26)