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

Systemtic Name: N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(3-oxidanyl-3-propan-2-yl-azetidin-1-yl)pyrimidin-2-yl]sulfanylphenyl]propanamide Openeye Name: N-[4-[4-(3-hydroxy-3-isopropyl-azetidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide CAS Name: N-[4-[[4-(3-hydroxy-3-propan-2-yl-1-azetidinyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]thio]phenyl]propanamide IUPAC Name: N-[4-[4-(3-hydroxy-3-propan-2-ylazetidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide Traditional Name: N-[4-[[4-(3-hydroxy-3-isopropyl-azetidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]thio]phenyl]propionamide Formula: C23H29N7O2S MolecularWeight: 467.58706

Click to see the large picture

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)O

Isomeric SMILES

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

InChI

InChI=1S/C23H29N7O2S/c1-5-21(31)24-16-6-8-17(9-7-16)33-22-26-18(25-19-10-15(4)28-29-19)11-20(27-22)30-12-23(32,13-30)14(2)3/h6-11,14,32H,5,12-13H2,1-4H3,(H,24,31)(H2,25,26,27,28,29)