(2S)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-N-(2-methylpropyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-N-(2-methylpropyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-isobutyl-1-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-N-(2-methylpropyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]-N-(2-methylpropyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-isobutyl-1-(1-tosylisonipecotoyl)pyrrolidine-2-carboxamide Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCC3C(=O)NCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC[C@H]3C(=O)NCC(C)C

InChI

InChI=1S/C22H33N3O4S/c1-16(2)15-23-21(26)20-5-4-12-25(20)22(27)18-10-13-24(14-11-18)30(28,29)19-8-6-17(3)7-9-19/h6-9,16,18,20H,4-5,10-15H2,1-3H3,(H,23,26)/t20-/m0/s1