1-[(3-methylphenyl)methylsulfonyl]-N-(2-pyrrolidin-1-ylcarbonylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(3-methylphenyl)methylsulfonyl]-N-(2-pyrrolidin-1-ylcarbonylphenyl)piperidine-4-carboxamide Openeye Name: 1-(m-tolylmethylsulfonyl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[2-(pyrrolidine-1-carbonyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3-methylbenzyl)sulfonyl-N-[2-(pyrrolidine-1-carbonyl)phenyl]isonipecotamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)N4CCCC4

InChI

InChI=1S/C25H31N3O4S/c1-19-7-6-8-20(17-19)18-33(31,32)28-15-11-21(12-16-28)24(29)26-23-10-3-2-9-22(23)25(30)27-13-4-5-14-27/h2-3,6-10,17,21H,4-5,11-16,18H2,1H3,(H,26,29)