N-[(4-methylphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: 1-[(4-methyl-1-piperidyl)sulfonyl]-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-1-[(4-methyl-1-piperidinyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(4-methylbenzyl)-1-(4-methylpiperidino)sulfonyl-nipecotamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=C(C=C3)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=C(C=C3)C

InChI

InChI=1S/C20H31N3O3S/c1-16-5-7-18(8-6-16)14-21-20(24)19-4-3-11-23(15-19)27(25,26)22-12-9-17(2)10-13-22/h5-8,17,19H,3-4,9-15H2,1-2H3,(H,21,24)