N,N-diethyl-4-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]carbonyl]piperazine-1-sulfonamide

Systemtic Name: N,N-diethyl-4-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]carbonyl]piperazine-1-sulfonamide Openeye Name: N,N-diethyl-4-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]piperazine-1-sulfonamide CAS Name: N,N-diethyl-4-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-oxomethyl]-1-piperazinesulfonamide IUPAC Name: N,N-diethyl-4-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]piperazine-1-sulfonamide Traditional Name: N,N-diethyl-4-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]piperazine-1-sulfonamide Formula: C18H24FN5O3S MolecularWeight: 409.478263

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CCN(CC1)C(=O)C2=C(NN=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CCN(CC1)C(=O)C2=C(NN=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H24FN5O3S/c1-3-23(4-2)28(26,27)24-11-9-22(10-12-24)18(25)16-13-20-21-17(16)14-5-7-15(19)8-6-14/h5-8,13H,3-4,9-12H2,1-2H3,(H,20,21)