1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide

Systemtic Name: 1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide Openeye Name: 1-[4-cyano-2-(2-furyl)oxazol-5-yl]-N-[5-(1-piperidyl)-8-isoquinolyl]piperidine-4-carboxamide CAS Name: 1-[4-cyano-2-(2-furanyl)-5-oxazolyl]-N-[5-(1-piperidinyl)-8-isoquinolinyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]-N-(5-piperidin-1-ylisoquinolin-8-yl)piperidine-4-carboxamide Traditional Name: 1-[4-cyano-2-(2-furyl)oxazol-5-yl]-N-(5-piperidino-8-isoquinolyl)isonipecotamide Formula: C28H28N6O3 MolecularWeight: 496.56032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4CCN(CC4)C5=C(N=C(O5)C6=CC=CO6)C#N

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)C4CCN(CC4)C5=C(N=C(O5)C6=CC=CO6)C#N

InChI

InChI=1S/C28H28N6O3/c29-17-23-28(37-27(32-23)25-5-4-16-36-25)34-14-9-19(10-15-34)26(35)31-22-6-7-24(33-12-2-1-3-13-33)20-8-11-30-18-21(20)22/h4-8,11,16,18-19H,1-3,9-10,12-15H2,(H,31,35)