5-(4-chloranyl-3-nitro-phenyl)-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 5-(4-chloranyl-3-nitro-phenyl)-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 5-(4-chloro-3-nitro-phenyl)-6-ethyl-pyrimidine-2,4-diamine CAS Name: 5-(4-chloro-3-nitrophenyl)-6-ethylpyrimidine-2,4-diamine IUPAC Name: 5-(4-chloro-3-nitrophenyl)-6-ethylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-(4-chloro-3-nitro-phenyl)-6-ethyl-pyrimidin-4-yl]amine Formula: C12H12ClN5O2 MolecularWeight: 293.70898

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN5O2/c1-2-8-10(11(14)17-12(15)16-8)6-3-4-7(13)9(5-6)18(19)20/h3-5H,2H2,1H3,(H4,14,15,16,17)