N4-ethyl-N6-(2-methoxyethyl)-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-ethyl-N6-(2-methoxyethyl)-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-ethyl-N6-(2-methoxyethyl)-N4-(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-ethyl-N6-(2-methoxyethyl)-N4-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-ethyl-6-N-(2-methoxyethyl)-4-N-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: ethyl-[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]-(m-tolyl)amine Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2[N+](=O)[O-])NCCOC

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=NC=NC(=C2[N+](=O)[O-])NCCOC

InChI

InChI=1S/C16H21N5O3/c1-4-20(13-7-5-6-12(2)10-13)16-14(21(22)23)15(18-11-19-16)17-8-9-24-3/h5-7,10-11H,4,8-9H2,1-3H3,(H,17,18,19)