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

Systemtic Name: 1-(2-azanyl-6-phenylazanyl-pyrimidin-4-yl)-N-cyclopentyl-piperidine-4-carboxamide Openeye Name: 1-(2-amino-6-anilino-pyrimidin-4-yl)-N-cyclopentyl-piperidine-4-carboxamide CAS Name: 1-(2-amino-6-anilino-4-pyrimidinyl)-N-cyclopentyl-4-piperidinecarboxamide IUPAC Name: 1-(2-amino-6-anilinopyrimidin-4-yl)-N-cyclopentylpiperidine-4-carboxamide Traditional Name: 1-(2-amino-6-anilino-pyrimidin-4-yl)-N-cyclopentyl-isonipecotamide Formula: C21H28N6O MolecularWeight: 380.48662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2CCN(CC2)C3=CC(=NC(=N3)N)NC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=O)C2CCN(CC2)C3=CC(=NC(=N3)N)NC4=CC=CC=C4

InChI

InChI=1S/C21H28N6O/c22-21-25-18(23-16-6-2-1-3-7-16)14-19(26-21)27-12-10-15(11-13-27)20(28)24-17-8-4-5-9-17/h1-3,6-7,14-15,17H,4-5,8-13H2,(H,24,28)(H3,22,23,25,26)