1-[2-azanyl-3-cyano-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-4-carboxamide

Systemtic Name: 1-[2-azanyl-3-cyano-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-4-carboxamide Openeye Name: 1-[2-amino-6-(2-benzyloxyphenyl)-3-cyano-4-pyridyl]piperidine-4-carboxamide CAS Name: 1-[2-amino-3-cyano-6-(2-phenylmethoxyphenyl)-4-pyridinyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-amino-3-cyano-6-(2-phenylmethoxyphenyl)pyridin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[2-amino-6-(2-benzoxyphenyl)-3-cyano-4-pyridyl]isonipecotamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C2=CC(=NC(=C2C#N)N)C3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N)C2=CC(=NC(=C2C#N)N)C3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C25H25N5O2/c26-15-20-22(30-12-10-18(11-13-30)25(28)31)14-21(29-24(20)27)19-8-4-5-9-23(19)32-16-17-6-2-1-3-7-17/h1-9,14,18H,10-13,16H2,(H2,27,29)(H2,28,31)