N-[2-(diethylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(diethylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[2-(diethylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[diethylamino(oxo)methyl]phenyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(diethylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-(diethylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C26H35N3O4S/c1-3-28(4-2)26(31)23-14-8-9-15-24(23)27-25(30)22-16-18-29(19-17-22)34(32,33)20-10-13-21-11-6-5-7-12-21/h5-9,11-12,14-15,22H,3-4,10,13,16-20H2,1-2H3,(H,27,30)