1-[(3-methylphenyl)methylsulfonyl]-N-phenethyl-piperidine-4-carboxamide

Systemtic Name: 1-[(3-methylphenyl)methylsulfonyl]-N-phenethyl-piperidine-4-carboxamide Openeye Name: 1-(m-tolylmethylsulfonyl)-N-phenethyl-piperidine-4-carboxamide CAS Name: 1-[(3-methylphenyl)methylsulfonyl]-N-phenethyl-4-piperidinecarboxamide IUPAC Name: 1-[(3-methylphenyl)methylsulfonyl]-N-phenethylpiperidine-4-carboxamide Traditional Name: 1-(3-methylbenzyl)sulfonyl-N-phenethyl-isonipecotamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3S/c1-18-6-5-9-20(16-18)17-28(26,27)24-14-11-21(12-15-24)22(25)23-13-10-19-7-3-2-4-8-19/h2-9,16,21H,10-15,17H2,1H3,(H,23,25)