6-(2,6-dimethylmorpholin-4-yl)-N-[2-(4-ethylphenyl)ethyl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(2,6-dimethylmorpholin-4-yl)-N-[2-(4-ethylphenyl)ethyl]-5-nitro-pyrimidin-4-amine Openeye Name: 6-(2,6-dimethylmorpholin-4-yl)-N-[2-(4-ethylphenyl)ethyl]-5-nitro-pyrimidin-4-amine CAS Name: 6-(2,6-dimethyl-4-morpholinyl)-N-[2-(4-ethylphenyl)ethyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-(2,6-dimethylmorpholin-4-yl)-N-[2-(4-ethylphenyl)ethyl]-5-nitropyrimidin-4-amine Traditional Name: [6-(2,6-dimethylmorpholino)-5-nitro-pyrimidin-4-yl]-[2-(4-ethylphenyl)ethyl]amine Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCNC2=NC=NC(=C2[N+](=O)[O-])N3CC(OC(C3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)CCNC2=NC=NC(=C2[N+](=O)[O-])N3CC(OC(C3)C)C

InChI

InChI=1S/C20H27N5O3/c1-4-16-5-7-17(8-6-16)9-10-21-19-18(25(26)27)20(23-13-22-19)24-11-14(2)28-15(3)12-24/h5-8,13-15H,4,9-12H2,1-3H3,(H,21,22,23)