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

Systemtic Name: N-[4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(4-oxidanyl-4-propan-2-yl-piperidin-1-yl)pyrimidin-2-yl]sulfanylphenyl]propanamide Openeye Name: N-[4-[4-(4-hydroxy-4-isopropyl-1-piperidyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide CAS Name: N-[4-[[4-(4-hydroxy-4-propan-2-yl-1-piperidinyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]thio]phenyl]propanamide IUPAC Name: N-[4-[4-(4-hydroxy-4-propan-2-ylpiperidin-1-yl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]propanamide Traditional Name: N-[4-[[4-(4-hydroxy-4-isopropyl-piperidino)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]thio]phenyl]propionamide Formula: C25H33N7O2S MolecularWeight: 495.64022

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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)N4CCC(CC4)(C(C)C)O

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)SC2=NC(=CC(=N2)NC3=NNC(=C3)C)N4CCC(CC4)(C(C)C)O

InChI

InChI=1S/C25H33N7O2S/c1-5-23(33)26-18-6-8-19(9-7-18)35-24-28-20(27-21-14-17(4)30-31-21)15-22(29-24)32-12-10-25(34,11-13-32)16(2)3/h6-9,14-16,34H,5,10-13H2,1-4H3,(H,26,33)(H2,27,28,29,30,31)