N-[4-[4-(3-cyclopropyl-3-fluoranyl-azetidin-1-yl)-6-(pyridin-2-ylamino)pyrimidin-2-yl]sulfanylphenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[4-(3-cyclopropyl-3-fluoranyl-azetidin-1-yl)-6-(pyridin-2-ylamino)pyrimidin-2-yl]sulfanylphenyl]cyclopropanecarboxamide Openeye Name: N-[4-[4-(3-cyclopropyl-3-fluoro-azetidin-1-yl)-6-(2-pyridylamino)pyrimidin-2-yl]sulfanylphenyl]cyclopropanecarboxamide CAS Name: N-[4-[[4-(3-cyclopropyl-3-fluoro-1-azetidinyl)-6-(2-pyridinylamino)-2-pyrimidinyl]thio]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[4-(3-cyclopropyl-3-fluoroazetidin-1-yl)-6-(pyridin-2-ylamino)pyrimidin-2-yl]sulfanylphenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[4-(3-cyclopropyl-3-fluoro-azetidin-1-yl)-6-(2-pyridylamino)pyrimidin-2-yl]thio]phenyl]cyclopropanecarboxamide Formula: C25H25FN6OS MolecularWeight: 476.569003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(C=C2)SC3=NC(=CC(=N3)NC4=CC=CC=N4)N5CC(C5)(C6CC6)F

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(C=C2)SC3=NC(=CC(=N3)NC4=CC=CC=N4)N5CC(C5)(C6CC6)F

InChI

InChI=1S/C25H25FN6OS/c26-25(17-6-7-17)14-32(15-25)22-13-21(29-20-3-1-2-12-27-20)30-24(31-22)34-19-10-8-18(9-11-19)28-23(33)16-4-5-16/h1-3,8-13,16-17H,4-7,14-15H2,(H,28,33)(H,27,29,30,31)