5-nitro-N-(4-phenoxyphenyl)-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine

Systemtic Name: 5-nitro-N-(4-phenoxyphenyl)-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Openeye Name: 6-(4-isopropylphenoxy)-5-nitro-N-(4-phenoxyphenyl)pyrimidin-4-amine CAS Name: 5-nitro-N-(4-phenoxyphenyl)-6-(4-propan-2-ylphenoxy)-4-pyrimidinamine IUPAC Name: 5-nitro-N-(4-phenoxyphenyl)-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Traditional Name: [6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-(4-phenoxyphenyl)amine Formula: C25H22N4O4 MolecularWeight: 442.46658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H22N4O4/c1-17(2)18-8-12-22(13-9-18)33-25-23(29(30)31)24(26-16-27-25)28-19-10-14-21(15-11-19)32-20-6-4-3-5-7-20/h3-17H,1-2H3,(H,26,27,28)