N-[2-chloranyl-5-(dimethylcarbamoyl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-chloranyl-5-(dimethylcarbamoyl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[2-chloro-5-(dimethylcarbamoyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-chloro-5-[dimethylamino(oxo)methyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[2-chloro-5-(dimethylcarbamoyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[2-chloro-5-(dimethylcarbamoyl)phenyl]isonipecotamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)C(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24ClN3O4S/c1-24(2)21(27)16-8-9-18(22)19(14-16)23-20(26)15-10-12-25(13-11-15)30(28,29)17-6-4-3-5-7-17/h3-9,14-15H,10-13H2,1-2H3,(H,23,26)