1-[4-cyano-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazol-5-yl]piperidine-4-carboxamide

Systemtic Name: 1-[4-cyano-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazol-5-yl]piperidine-4-carboxamide Openeye Name: 1-[4-cyano-2-[4-(1-piperidylsulfonyl)phenyl]oxazol-5-yl]piperidine-4-carboxamide CAS Name: 1-[4-cyano-2-[4-(1-piperidinylsulfonyl)phenyl]-5-oxazolyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-cyano-2-(4-piperidin-1-ylsulfonylphenyl)-1,3-oxazol-5-yl]piperidine-4-carboxamide Traditional Name: 1-[4-cyano-2-(4-piperidinosulfonylphenyl)oxazol-5-yl]isonipecotamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)N4CCC(CC4)C(=O)N)C#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)N4CCC(CC4)C(=O)N)C#N

InChI

InChI=1S/C21H25N5O4S/c22-14-18-21(25-12-8-15(9-13-25)19(23)27)30-20(24-18)16-4-6-17(7-5-16)31(28,29)26-10-2-1-3-11-26/h4-7,15H,1-3,8-13H2,(H2,23,27)