6-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(2-chloranylpyridin-3-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(2-chloranylpyridin-3-yl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3,5-dimethyl-phenoxy)-N-(2-chloro-3-pyridyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-chloro-3,5-dimethylphenoxy)-N-(2-chloro-3-pyridinyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3,5-dimethylphenoxy)-N-(2-chloropyridin-3-yl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]-(2-chloro-3-pyridyl)amine Formula: C17H13Cl2N5O3 MolecularWeight: 406.22282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(N=CC=C3)Cl

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(N=CC=C3)Cl

InChI

InChI=1S/C17H13Cl2N5O3/c1-9-6-11(7-10(2)13(9)18)27-17-14(24(25)26)16(21-8-22-17)23-12-4-3-5-20-15(12)19/h3-8H,1-2H3,(H,21,22,23)