5-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-1,2-oxazol-3-amine

Systemtic Name: 5-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-1,2-oxazol-3-amine Openeye Name: N-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-5-methyl-isoxazol-3-amine CAS Name: 5-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]-3-isoxazolamine IUPAC Name: 5-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-1,2-oxazol-3-amine Traditional Name: [6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-(5-methylisoxazol-3-yl)amine Formula: C17H17N5O4 MolecularWeight: 355.34798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=C(C(=NC=N2)OC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)NC2=C(C(=NC=N2)OC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4/c1-10(2)12-4-6-13(7-5-12)25-17-15(22(23)24)16(18-9-19-17)20-14-8-11(3)26-21-14/h4-10H,1-3H3,(H,18,19,20,21)