N-[3-[[5-cyclopropyl-2-(pyridin-3-ylamino)pyrimidin-4-yl]amino]propyl]cyclopentanecarboxamide

Systemtic Name: N-[3-[[5-cyclopropyl-2-(pyridin-3-ylamino)pyrimidin-4-yl]amino]propyl]cyclopentanecarboxamide Openeye Name: N-[3-[[5-cyclopropyl-2-(3-pyridylamino)pyrimidin-4-yl]amino]propyl]cyclopentanecarboxamide CAS Name: N-[3-[[5-cyclopropyl-2-(3-pyridinylamino)-4-pyrimidinyl]amino]propyl]cyclopentanecarboxamide IUPAC Name: N-[3-[[5-cyclopropyl-2-(pyridin-3-ylamino)pyrimidin-4-yl]amino]propyl]cyclopentanecarboxamide Traditional Name: N-[3-[[5-cyclopropyl-2-(3-pyridylamino)pyrimidin-4-yl]amino]propyl]cyclopentanecarboxamide Formula: C21H28N6O MolecularWeight: 380.48662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NCCCNC2=NC(=NC=C2C3CC3)NC4=CN=CC=C4

Isomeric SMILES

C1CCC(C1)C(=O)NCCCNC2=NC(=NC=C2C3CC3)NC4=CN=CC=C4

InChI

InChI=1S/C21H28N6O/c28-20(16-5-1-2-6-16)24-12-4-11-23-19-18(15-8-9-15)14-25-21(27-19)26-17-7-3-10-22-13-17/h3,7,10,13-16H,1-2,4-6,8-9,11-12H2,(H,24,28)(H2,23,25,26,27)