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

Systemtic Name: N-[2-(3-methoxypropylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[2-(3-methoxypropylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[(3-methoxypropylamino)-oxomethyl]phenyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(3-methoxypropylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-(3-methoxypropylcarbamoyl)phenyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C26H35N3O5S MolecularWeight: 501.6382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35N3O5S/c1-34-19-8-16-27-26(31)23-12-5-6-13-24(23)28-25(30)22-14-17-29(18-15-22)35(32,33)20-7-11-21-9-3-2-4-10-21/h2-6,9-10,12-13,22H,7-8,11,14-20H2,1H3,(H,27,31)(H,28,30)