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

Systemtic Name: (2S)-1-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]carbonyl-N-propyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-propyl-1-[1-(p-tolylsulfonyl)piperidine-4-carbonyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-N-propyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]-N-propylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-propyl-1-(1-tosylisonipecotoyl)pyrrolidine-2-carboxamide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCNC(=O)[C@@H]1CCCN1C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H31N3O4S/c1-3-12-22-20(25)19-5-4-13-24(19)21(26)17-10-14-23(15-11-17)29(27,28)18-8-6-16(2)7-9-18/h6-9,17,19H,3-5,10-15H2,1-2H3,(H,22,25)/t19-/m0/s1