(2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-(phenylmethyl)pyrimidin-2-yl]-N-methyl-azetidine-2-carboxamide

Systemtic Name: (2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-(phenylmethyl)pyrimidin-2-yl]-N-methyl-azetidine-2-carboxamide Openeye Name: (2S)-1-[4-benzyl-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-methyl-azetidine-2-carboxamide CAS Name: (2S)-1-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-(phenylmethyl)-2-pyrimidinyl]-N-methyl-2-azetidinecarboxamide IUPAC Name: (2S)-1-[4-benzyl-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-methylazetidine-2-carboxamide Traditional Name: (2S)-1-[4-benzyl-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]-N-methyl-azetidine-2-carboxamide Formula: C22H25N7O MolecularWeight: 403.4802

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CCN1C2=NC(=CC(=N2)NC3=NNC(=C3)C4CC4)CC5=CC=CC=C5

Isomeric SMILES

CNC(=O)[C@@H]1CCN1C2=NC(=CC(=N2)NC3=NNC(=C3)C4CC4)CC5=CC=CC=C5

InChI

InChI=1S/C22H25N7O/c1-23-21(30)18-9-10-29(18)22-24-16(11-14-5-3-2-4-6-14)12-19(26-22)25-20-13-17(27-28-20)15-7-8-15/h2-6,12-13,15,18H,7-11H2,1H3,(H,23,30)(H2,24,25,26,27,28)/t18-/m0/s1