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

Systemtic Name: N-(2,3-dimethylphenyl)-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-1-(m-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2,3-dimethylphenyl)-1-[(3-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(2,3-dimethylphenyl)-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)NC3=CC=CC(=C3C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O3S/c1-16-6-4-8-19(14-16)15-28(26,27)24-12-10-20(11-13-24)22(25)23-21-9-5-7-17(2)18(21)3/h4-9,14,20H,10-13,15H2,1-3H3,(H,23,25)