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

Systemtic Name: 1-[4-cyano-2-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-oxazol-5-yl]piperidine-4-carboxamide Openeye Name: 1-[4-cyano-2-(4-pyrrolidin-1-ylsulfonylphenyl)oxazol-5-yl]piperidine-4-carboxamide CAS Name: 1-[4-cyano-2-[4-(1-pyrrolidinylsulfonyl)phenyl]-5-oxazolyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-cyano-2-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-oxazol-5-yl]piperidine-4-carboxamide Traditional Name: 1-[4-cyano-2-(4-pyrrolidinosulfonylphenyl)oxazol-5-yl]isonipecotamide Formula: C20H23N5O4S MolecularWeight: 429.49272

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)N4CCC(CC4)C(=O)N)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=C(O3)N4CCC(CC4)C(=O)N)C#N

InChI

InChI=1S/C20H23N5O4S/c21-13-17-20(24-11-7-14(8-12-24)18(22)26)29-19(23-17)15-3-5-16(6-4-15)30(27,28)25-9-1-2-10-25/h3-6,14H,1-2,7-12H2,(H2,22,26)