N-(3-fluoranyl-4-methyl-phenyl)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-1-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]pyrrolidine-2-carboxamide CAS Name: N-(3-fluoro-4-methylphenyl)-1-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]pyrrolidine-2-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-1-(1-tosylisonipecotoyl)pyrrolidine-2-carboxamide Formula: C25H30FN3O4S MolecularWeight: 487.586803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC(=C(C=C4)C)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC(=C(C=C4)C)F

InChI

InChI=1S/C25H30FN3O4S/c1-17-5-9-21(10-6-17)34(32,33)28-14-11-19(12-15-28)25(31)29-13-3-4-23(29)24(30)27-20-8-7-18(2)22(26)16-20/h5-10,16,19,23H,3-4,11-15H2,1-2H3,(H,27,30)