N-[2-(3,5-dimethoxyphenyl)ethyl]-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[2-(3,5-dimethoxyphenyl)ethyl]-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-[2-(3,5-dimethoxyphenyl)ethyl]-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-[2-(3,5-dimethoxyphenyl)ethyl]-6-(2,6-dimethyl-4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[2-(3,5-dimethoxyphenyl)ethyl]-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine Traditional Name: 2-(3,5-dimethoxyphenyl)ethyl-[6-(2,6-dimethylmorpholino)-5-nitro-pyrimidin-4-yl]amine Formula: C20H27N5O5 MolecularWeight: 417.45888

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=C(C(=NC=N2)NCCC3=CC(=CC(=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C2=C(C(=NC=N2)NCCC3=CC(=CC(=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H27N5O5/c1-13-10-24(11-14(2)30-13)20-18(25(26)27)19(22-12-23-20)21-6-5-15-7-16(28-3)9-17(8-15)29-4/h7-9,12-14H,5-6,10-11H2,1-4H3,(H,21,22,23)