6-chloranyl-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[(2S)-2-(3-pyrazin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[(2S)-2-(3-pyrazin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine Openeye Name: 6-chloro-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[(2S)-2-(3-pyrazin-2-ylisoxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine CAS Name: 6-chloro-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[(2S)-2-[3-(2-pyrazinyl)-5-isoxazolyl]-1-pyrrolidinyl]-4-pyrimidinamine IUPAC Name: 6-chloro-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[(2S)-2-(3-pyrazin-2-yl-1,2-oxazol-5-yl)pyrrolidin-1-yl]pyrimidin-4-amine Traditional Name: [6-chloro-2-[(2S)-2-(3-pyrazin-2-ylisoxazol-5-yl)pyrrolidino]pyrimidin-4-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)amine Formula: C21H20ClN9O MolecularWeight: 449.8962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC(=CC(=N2)Cl)NC3=NNC(=C3)C4CC4)C5=CC(=NO5)C6=NC=CN=C6

Isomeric SMILES

C1C[C@H](N(C1)C2=NC(=CC(=N2)Cl)NC3=NNC(=C3)C4CC4)C5=CC(=NO5)C6=NC=CN=C6

InChI

InChI=1S/C21H20ClN9O/c22-18-10-19(26-20-9-13(28-29-20)12-3-4-12)27-21(25-18)31-7-1-2-16(31)17-8-14(30-32-17)15-11-23-5-6-24-15/h5-6,8-12,16H,1-4,7H2,(H2,25,26,27,28,29)/t16-/m0/s1