6-(3,5-dimethylphenoxy)-5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine

Systemtic Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine Openeye Name: N-benzyl-6-(3,5-dimethylphenoxy)-5-nitro-N-(2-pyridyl)pyrimidin-4-amine CAS Name: 6-(3,5-dimethylphenoxy)-5-nitro-N-(phenylmethyl)-N-(2-pyridinyl)-4-pyrimidinamine IUPAC Name: N-benzyl-6-(3,5-dimethylphenoxy)-5-nitro-N-pyridin-2-ylpyrimidin-4-amine Traditional Name: benzyl-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]-(2-pyridyl)amine Formula: C24H21N5O3 MolecularWeight: 427.45524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])N(CC3=CC=CC=C3)C4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])N(CC3=CC=CC=C3)C4=CC=CC=N4)C

InChI

InChI=1S/C24H21N5O3/c1-17-12-18(2)14-20(13-17)32-24-22(29(30)31)23(26-16-27-24)28(21-10-6-7-11-25-21)15-19-8-4-3-5-9-19/h3-14,16H,15H2,1-2H3