N-[4-[4-(3-cyclopropyl-3-oxidanyl-azetidin-1-yl)-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide

Systemtic Name: N-[4-[4-(3-cyclopropyl-3-oxidanyl-azetidin-1-yl)-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide Openeye Name: N-[4-[4-(3-cyclopropyl-3-hydroxy-azetidin-1-yl)-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide CAS Name: N-[4-[[4-(3-cyclopropyl-3-hydroxy-1-azetidinyl)-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]thio]phenyl]propanamide IUPAC Name: N-[4-[4-(3-cyclopropyl-3-hydroxyazetidin-1-yl)-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide Traditional Name: N-[4-[[4-(3-cyclopropyl-3-hydroxy-azetidin-1-yl)-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]thio]phenyl]propionamide Formula: C25H29N7O2S MolecularWeight: 491.60846

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=NNC(=C3)C4CC4)N5CC(C5)(C6CC6)O

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=NNC(=C3)C4CC4)N5CC(C5)(C6CC6)O

InChI

InChI=1S/C25H29N7O2S/c1-2-23(33)26-17-7-9-18(10-8-17)35-24-28-20(27-21-11-19(30-31-21)15-3-4-15)12-22(29-24)32-13-25(34,14-32)16-5-6-16/h7-12,15-16,34H,2-6,13-14H2,1H3,(H,26,33)(H2,27,28,29,30,31)