1-[3,5-dimethyl-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrazol-4-yl]sulfonyl-N-(4-fluorophenyl)piperidine-4-carboxamide

Systemtic Name: 1-[3,5-dimethyl-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrazol-4-yl]sulfonyl-N-(4-fluorophenyl)piperidine-4-carboxamide Openeye Name: 1-[3,5-dimethyl-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)pyrazol-4-yl]sulfonyl-N-(4-fluorophenyl)piperidine-4-carboxamide CAS Name: 1-[[3,5-dimethyl-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-4-pyrazolyl]sulfonyl]-N-(4-fluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-[3,5-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyrazol-4-yl]sulfonyl-N-(4-fluorophenyl)piperidine-4-carboxamide Traditional Name: N-(4-fluorophenyl)-1-[1-(2-keto-2-pyrrolidino-ethyl)-3,5-dimethyl-pyrazol-4-yl]sulfonyl-isonipecotamide Formula: C23H30FN5O4S MolecularWeight: 491.578803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCCC2)C)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCCC2)C)S(=O)(=O)N3CCC(CC3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C23H30FN5O4S/c1-16-22(17(2)29(26-16)15-21(30)27-11-3-4-12-27)34(32,33)28-13-9-18(10-14-28)23(31)25-20-7-5-19(24)6-8-20/h5-8,18H,3-4,9-15H2,1-2H3,(H,25,31)