N4-ethyl-N6-(1-methoxypropan-2-yl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N4-ethyl-N6-(1-methoxypropan-2-yl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N4-ethyl-N6-(2-methoxy-1-methyl-ethyl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N4-ethyl-N6-(1-methoxypropan-2-yl)-5-nitro-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 4-N-ethyl-6-N-(1-methoxypropan-2-yl)-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: ethyl-[6-[(2-methoxy-1-methyl-ethyl)amino]-5-nitro-pyrimidin-4-yl]-phenyl-amine Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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