N-[2-(4-tert-butylphenoxy)ethyl]-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(2-cyanophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(2-cyanophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(4-tert-butylphenoxy)ethyl]-1-(2-cyanophenyl)sulfonyl-isonipecotamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C25H31N3O4S/c1-25(2,3)21-8-10-22(11-9-21)32-17-14-27-24(29)19-12-15-28(16-13-19)33(30,31)23-7-5-4-6-20(23)18-26/h4-11,19H,12-17H2,1-3H3,(H,27,29)