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

Systemtic Name: N-[(2-methylphenyl)methyl]-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: 1-(m-tolylmethylsulfonyl)-N-(o-tolylmethyl)piperidine-4-carboxamide CAS Name: N-[(2-methylphenyl)methyl]-1-[(3-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[(2-methylphenyl)methyl]-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(2-methylbenzyl)-1-(3-methylbenzyl)sulfonyl-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)NCC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3C

InChI

InChI=1S/C22H28N2O3S/c1-17-6-5-8-19(14-17)16-28(26,27)24-12-10-20(11-13-24)22(25)23-15-21-9-4-3-7-18(21)2/h3-9,14,20H,10-13,15-16H2,1-2H3,(H,23,25)