N4,N4-diethyl-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N4-diethyl-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4,N4-diethyl-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N4-diethyl-N6-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-diethyl-6-N-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: diethyl-[6-(2-ethylanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)N(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)N(CC)CC)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O2/c1-4-12-9-7-8-10-13(12)19-15-14(21(22)23)16(18-11-17-15)20(5-2)6-3/h7-11H,4-6H2,1-3H3,(H,17,18,19)