1-[3-[[3-(pyrimidin-2-ylamino)phenyl]carbonylamino]propyl]piperidine-4-carboxamide

Systemtic Name: 1-[3-[[3-(pyrimidin-2-ylamino)phenyl]carbonylamino]propyl]piperidine-4-carboxamide Openeye Name: 1-[3-[[3-(pyrimidin-2-ylamino)benzoyl]amino]propyl]piperidine-4-carboxamide CAS Name: 1-[3-[[oxo-[3-(2-pyrimidinylamino)phenyl]methyl]amino]propyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-[[3-(pyrimidin-2-ylamino)benzoyl]amino]propyl]piperidine-4-carboxamide Traditional Name: 1-[3-[[3-(2-pyrimidylamino)benzoyl]amino]propyl]isonipecotamide Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CCCNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3

Isomeric SMILES

C1CN(CCC1C(=O)N)CCCNC(=O)C2=CC(=CC=C2)NC3=NC=CC=N3

InChI

InChI=1S/C20H26N6O2/c21-18(27)15-6-12-26(13-7-15)11-3-10-22-19(28)16-4-1-5-17(14-16)25-20-23-8-2-9-24-20/h1-2,4-5,8-9,14-15H,3,6-7,10-13H2,(H2,21,27)(H,22,28)(H,23,24,25)