1-(2-azanyl-6-phenylazanyl-pyrimidin-4-yl)-N-pentyl-piperidine-4-carboxamide

Systemtic Name: 1-(2-azanyl-6-phenylazanyl-pyrimidin-4-yl)-N-pentyl-piperidine-4-carboxamide Openeye Name: 1-(2-amino-6-anilino-pyrimidin-4-yl)-N-pentyl-piperidine-4-carboxamide CAS Name: 1-(2-amino-6-anilino-4-pyrimidinyl)-N-pentyl-4-piperidinecarboxamide IUPAC Name: 1-(2-amino-6-anilinopyrimidin-4-yl)-N-pentylpiperidine-4-carboxamide Traditional Name: 1-(2-amino-6-anilino-pyrimidin-4-yl)-N-amyl-isonipecotamide Formula: C21H30N6O MolecularWeight: 382.5025

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1CCN(CC1)C2=CC(=NC(=N2)N)NC3=CC=CC=C3

Isomeric SMILES

CCCCCNC(=O)C1CCN(CC1)C2=CC(=NC(=N2)N)NC3=CC=CC=C3

InChI

InChI=1S/C21H30N6O/c1-2-3-7-12-23-20(28)16-10-13-27(14-11-16)19-15-18(25-21(22)26-19)24-17-8-5-4-6-9-17/h4-6,8-9,15-16H,2-3,7,10-14H2,1H3,(H,23,28)(H3,22,24,25,26)