1-(3-ethanoylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(3-ethanoylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(3-acetylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(3-acetylphenyl)sulfonyl-N-[1-[4-(1-imidazolyl)phenyl]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-acetylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(3-acetylphenyl)sulfonyl-N-[1-(4-imidazol-1-ylphenyl)ethyl]isonipecotamide Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)C(=O)C

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)C(=O)C

InChI

InChI=1S/C25H28N4O4S/c1-18(20-6-8-23(9-7-20)28-15-12-26-17-28)27-25(31)21-10-13-29(14-11-21)34(32,33)24-5-3-4-22(16-24)19(2)30/h3-9,12,15-18,21H,10-11,13-14H2,1-2H3,(H,27,31)