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

Systemtic Name: 1-[3,5-dimethyl-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrazol-4-yl]sulfonyl-N-(3-fluoranyl-4-methyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-[3,5-dimethyl-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)pyrazol-4-yl]sulfonyl-N-(3-fluoro-4-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-[[3,5-dimethyl-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-4-pyrazolyl]sulfonyl]-N-(3-fluoro-4-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[3,5-dimethyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyrazol-4-yl]sulfonyl-N-(3-fluoro-4-methylphenyl)piperidine-4-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-1-[1-(2-keto-2-pyrrolidino-ethyl)-3,5-dimethyl-pyrazol-4-yl]sulfonyl-isonipecotamide Formula: C24H32FN5O4S MolecularWeight: 505.605383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N(N=C3C)CC(=O)N4CCCC4)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(N(N=C3C)CC(=O)N4CCCC4)C)F

InChI

InChI=1S/C24H32FN5O4S/c1-16-6-7-20(14-21(16)25)26-24(32)19-8-12-29(13-9-19)35(33,34)23-17(2)27-30(18(23)3)15-22(31)28-10-4-5-11-28/h6-7,14,19H,4-5,8-13,15H2,1-3H3,(H,26,32)