5-[4-(2-ethoxyethoxy)-3-nitro-phenyl]-6-ethyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[4-(2-ethoxyethoxy)-3-nitro-phenyl]-6-ethyl-pyrimidine-2,4-diamine Openeye Name: 5-[4-(2-ethoxyethoxy)-3-nitro-phenyl]-6-ethyl-pyrimidine-2,4-diamine CAS Name: 5-[4-(2-ethoxyethoxy)-3-nitrophenyl]-6-ethylpyrimidine-2,4-diamine IUPAC Name: 5-[4-(2-ethoxyethoxy)-3-nitrophenyl]-6-ethylpyrimidine-2,4-diamine Traditional Name: [2-amino-5-[4-(2-ethoxyethoxy)-3-nitro-phenyl]-6-ethyl-pyrimidin-4-yl]amine Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5O4/c1-3-11-14(15(17)20-16(18)19-11)10-5-6-13(12(9-10)21(22)23)25-8-7-24-4-2/h5-6,9H,3-4,7-8H2,1-2H3,(H4,17,18,19,20)