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

Systemtic Name: N-[4-[4-(3-tert-butyl-3-oxidanyl-azetidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide Openeye Name: N-[4-[4-(3-tert-butyl-3-hydroxy-azetidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide CAS Name: N-[4-[[4-(3-tert-butyl-3-hydroxy-1-azetidinyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]thio]phenyl]propanamide IUPAC Name: N-[4-[4-(3-tert-butyl-3-hydroxyazetidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide Traditional Name: N-[4-[[4-(3-tert-butyl-3-hydroxy-azetidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]thio]phenyl]propionamide Formula: C24H31N7O2S MolecularWeight: 481.61364

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=NNC(=C3)C)N4CC(C4)(C(C)(C)C)O

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=NNC(=C3)C)N4CC(C4)(C(C)(C)C)O

InChI

InChI=1S/C24H31N7O2S/c1-6-21(32)25-16-7-9-17(10-8-16)34-22-27-18(26-19-11-15(2)29-30-19)12-20(28-22)31-13-24(33,14-31)23(3,4)5/h7-12,33H,6,13-14H2,1-5H3,(H,25,32)(H2,26,27,28,29,30)