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

Systemtic Name: N-(4-acetamidophenyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(4-acetamidophenyl)-1-(o-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-(4-acetamidophenyl)-1-[(2-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(4-acetamidophenyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(4-acetamidophenyl)-1-(2-methylbenzyl)sulfonyl-isonipecotamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H27N3O4S/c1-16-5-3-4-6-19(16)15-30(28,29)25-13-11-18(12-14-25)22(27)24-21-9-7-20(8-10-21)23-17(2)26/h3-10,18H,11-15H2,1-2H3,(H,23,26)(H,24,27)