2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N4-(4-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N4-(4-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N4-(4-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: 2-[(2S,6S)-2,6-dimethyl-4-morpholinyl]-N4-(4-ethoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-4-N-(4-ethoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(2S,6S)-2,6-dimethylmorpholino]-5-nitro-pyrimidin-4-yl]-p-phenetyl-amine Formula: C18H24N6O4 MolecularWeight: 388.42096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)N3CC(OC(C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)N3C[C@@H](O[C@H](C3)C)C

InChI

InChI=1S/C18H24N6O4/c1-4-27-14-7-5-13(6-8-14)20-17-15(24(25)26)16(19)21-18(22-17)23-9-11(2)28-12(3)10-23/h5-8,11-12H,4,9-10H2,1-3H3,(H3,19,20,21,22)/t11-,12-/m0/s1