N6-(5-chloranylpyridin-2-yl)-5-nitro-N4-(1-phenylethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-(5-chloranylpyridin-2-yl)-5-nitro-N4-(1-phenylethyl)pyrimidine-4,6-diamine Openeye Name: N6-(5-chloro-2-pyridyl)-5-nitro-N4-(1-phenylethyl)pyrimidine-4,6-diamine CAS Name: N6-(5-chloro-2-pyridinyl)-5-nitro-N4-(1-phenylethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-(5-chloropyridin-2-yl)-5-nitro-4-N-(1-phenylethyl)pyrimidine-4,6-diamine Traditional Name: (5-chloro-2-pyridyl)-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]amine Formula: C17H15ClN6O2 MolecularWeight: 370.793

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN6O2/c1-11(12-5-3-2-4-6-12)22-16-15(24(25)26)17(21-10-20-16)23-14-8-7-13(18)9-19-14/h2-11H,1H3,(H2,19,20,21,22,23)