N2-[(3-phenyl-1,2-oxazol-5-yl)methyl]-N4-(5-propan-2-yl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine

Systemtic Name: N2-[(3-phenyl-1,2-oxazol-5-yl)methyl]-N4-(5-propan-2-yl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Openeye Name: N4-(5-isopropyl-1H-pyrazol-3-yl)-N2-[(3-phenylisoxazol-5-yl)methyl]pyrimidine-2,4-diamine CAS Name: N2-[(3-phenyl-5-isoxazolyl)methyl]-N4-(5-propan-2-yl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine IUPAC Name: 2-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-4-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Traditional Name: (5-isopropyl-1H-pyrazol-3-yl)-[2-[(3-phenylisoxazol-5-yl)methylamino]pyrimidin-4-yl]amine Formula: C20H21N7O MolecularWeight: 375.42704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NN1)NC2=NC(=NC=C2)NCC3=CC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC(=NN1)NC2=NC(=NC=C2)NCC3=CC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N7O/c1-13(2)16-11-19(26-25-16)23-18-8-9-21-20(24-18)22-12-15-10-17(27-28-15)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H3,21,22,23,24,25,26)