N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N6-methyl-2-[(2S)-2-(3-pyrazin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidine-4,6-diamine

Systemtic Name: N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N6-methyl-2-[(2S)-2-(3-pyrazin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidine-4,6-diamine Openeye Name: N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N6-methyl-2-[(2S)-2-(3-pyrazin-2-ylisoxazol-5-yl)pyrrolidin-1-yl]pyrimidine-4,6-diamine CAS Name: N4-(5-cyclopropyl-1H-pyrazol-3-yl)-N6-methyl-2-[(2S)-2-[3-(2-pyrazinyl)-5-isoxazolyl]-1-pyrrolidinyl]pyrimidine-4,6-diamine IUPAC Name: 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-N-methyl-2-[(2S)-2-(3-pyrazin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidine-4,6-diamine Traditional Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[6-(methylamino)-2-[(2S)-2-(3-pyrazin-2-ylisoxazol-5-yl)pyrrolidino]pyrimidin-4-yl]amine Formula: C22H24N10O MolecularWeight: 444.49236

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC(=C1)NC2=NNC(=C2)C3CC3)N4CCCC4C5=CC(=NO5)C6=NC=CN=C6

Isomeric SMILES

CNC1=NC(=NC(=C1)NC2=NNC(=C2)C3CC3)N4CCC[C@H]4C5=CC(=NO5)C6=NC=CN=C6

InChI

InChI=1S/C22H24N10O/c1-23-19-11-20(26-21-10-14(29-30-21)13-4-5-13)28-22(27-19)32-8-2-3-17(32)18-9-15(31-33-18)16-12-24-6-7-25-16/h6-7,9-13,17H,2-5,8H2,1H3,(H3,23,26,27,28,29,30)/t17-/m0/s1