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

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

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

COCCCNC(=O)C1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

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