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

Systemtic Name: N-(5-chloranylpyridin-2-yl)-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: N-(5-chloro-2-pyridyl)-6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(5-chloro-2-pyridinyl)-6-(3,5-dimethylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-(5-chloropyridin-2-yl)-6-(3,5-dimethylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: (5-chloro-2-pyridyl)-[6-(3,5-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C17H14ClN5O3 MolecularWeight: 371.77776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Cl)C

InChI

InChI=1S/C17H14ClN5O3/c1-10-5-11(2)7-13(6-10)26-17-15(23(24)25)16(20-9-21-17)22-14-4-3-12(18)8-19-14/h3-9H,1-2H3,(H,19,20,21,22)