N-butyl-2-(3-methylphenyl)-5-thiomorpholin-4-ylcarbonyl-piperidine-1-carboxamide

Systemtic Name: N-butyl-2-(3-methylphenyl)-5-thiomorpholin-4-ylcarbonyl-piperidine-1-carboxamide Openeye Name: N-butyl-2-(m-tolyl)-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide CAS Name: N-butyl-2-(3-methylphenyl)-5-[oxo(thiomorpholin-4-yl)methyl]-1-piperidinecarboxamide IUPAC Name: N-butyl-2-(3-methylphenyl)-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide Traditional Name: N-butyl-2-(m-tolyl)-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide Formula: C22H33N3O2S MolecularWeight: 403.58132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CC(CCC1C2=CC(=CC=C2)C)C(=O)N3CCSCC3

Isomeric SMILES

CCCCNC(=O)N1CC(CCC1C2=CC(=CC=C2)C)C(=O)N3CCSCC3

InChI

InChI=1S/C22H33N3O2S/c1-3-4-10-23-22(27)25-16-19(21(26)24-11-13-28-14-12-24)8-9-20(25)18-7-5-6-17(2)15-18/h5-7,15,19-20H,3-4,8-14,16H2,1-2H3,(H,23,27)