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

Systemtic Name: N4-(3-propan-2-yloxy-1H-pyrazol-5-yl)-N2-[(3-pyrimidin-5-yl-1,2-oxazol-5-yl)methyl]pyrimidine-2,4-diamine Openeye Name: N4-(3-isopropoxy-1H-pyrazol-5-yl)-N2-[(3-pyrimidin-5-ylisoxazol-5-yl)methyl]pyrimidine-2,4-diamine CAS Name: N4-(3-propan-2-yloxy-1H-pyrazol-5-yl)-N2-[[3-(5-pyrimidinyl)-5-isoxazolyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(3-propan-2-yloxy-1H-pyrazol-5-yl)-2-N-[(3-pyrimidin-5-yl-1,2-oxazol-5-yl)methyl]pyrimidine-2,4-diamine Traditional Name: (3-isopropoxy-1H-pyrazol-5-yl)-[2-[[3-(5-pyrimidyl)isoxazol-5-yl]methylamino]pyrimidin-4-yl]amine Formula: C18H19N9O2 MolecularWeight: 393.40256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NNC(=C1)NC2=NC(=NC=C2)NCC3=CC(=NO3)C4=CN=CN=C4

Isomeric SMILES

CC(C)OC1=NNC(=C1)NC2=NC(=NC=C2)NCC3=CC(=NO3)C4=CN=CN=C4

InChI

InChI=1S/C18H19N9O2/c1-11(2)28-17-6-16(25-26-17)23-15-3-4-21-18(24-15)22-9-13-5-14(27-29-13)12-7-19-10-20-8-12/h3-8,10-11H,9H2,1-2H3,(H3,21,22,23,24,25,26)