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

Systemtic Name: N-[2-(diethylcarbamoyl)phenyl]-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[2-(diethylcarbamoyl)phenyl]-1-(p-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[diethylamino(oxo)methyl]phenyl]-1-[(4-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(diethylcarbamoyl)phenyl]-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-[2-(diethylcarbamoyl)phenyl]-1-(4-methylbenzyl)sulfonyl-isonipecotamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)C

InChI

InChI=1S/C25H33N3O4S/c1-4-27(5-2)25(30)22-8-6-7-9-23(22)26-24(29)21-14-16-28(17-15-21)33(31,32)18-20-12-10-19(3)11-13-20/h6-13,21H,4-5,14-18H2,1-3H3,(H,26,29)