1-[3-(2-cyano-6-cycloheptyl-pyrimidin-4-yl)propyl]-N,N-diethyl-piperidine-3-carboxamide

Systemtic Name: 1-[3-(2-cyano-6-cycloheptyl-pyrimidin-4-yl)propyl]-N,N-diethyl-piperidine-3-carboxamide Openeye Name: 1-[3-(2-cyano-6-cycloheptyl-pyrimidin-4-yl)propyl]-N,N-diethyl-piperidine-3-carboxamide CAS Name: 1-[3-(2-cyano-6-cycloheptyl-4-pyrimidinyl)propyl]-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: 1-[3-(2-cyano-6-cycloheptylpyrimidin-4-yl)propyl]-N,N-diethylpiperidine-3-carboxamide Traditional Name: 1-[3-(2-cyano-6-cycloheptyl-pyrimidin-4-yl)propyl]-N,N-diethyl-nipecotamide Formula: C25H39N5O MolecularWeight: 425.61006

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)CCCC2=NC(=NC(=C2)C3CCCCCC3)C#N

Isomeric SMILES

CCN(CC)C(=O)C1CCCN(C1)CCCC2=NC(=NC(=C2)C3CCCCCC3)C#N

InChI

InChI=1S/C25H39N5O/c1-3-30(4-2)25(31)21-13-9-15-29(19-21)16-10-14-22-17-23(28-24(18-26)27-22)20-11-7-5-6-8-12-20/h17,20-21H,3-16,19H2,1-2H3