4,6-dimethyl-N-[(E)-(2-morpholin-4-yl-5-nitro-phenyl)methylideneamino]pyrimidin-2-amine

Systemtic Name: 4,6-dimethyl-N-[(E)-(2-morpholin-4-yl-5-nitro-phenyl)methylideneamino]pyrimidin-2-amine Openeye Name: 4,6-dimethyl-N-[(E)-(2-morpholino-5-nitro-phenyl)methyleneamino]pyrimidin-2-amine CAS Name: 4,6-dimethyl-N-[(E)-[2-(4-morpholinyl)-5-nitrophenyl]methylideneamino]-2-pyrimidinamine IUPAC Name: 4,6-dimethyl-N-[(E)-(2-morpholin-4-yl-5-nitrophenyl)methylideneamino]pyrimidin-2-amine Traditional Name: (4,6-dimethylpyrimidin-2-yl)-[(E)-(2-morpholino-5-nitro-benzylidene)amino]amine Formula: C17H20N6O3 MolecularWeight: 356.3791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N/N=C/C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3)C

InChI

InChI=1S/C17H20N6O3/c1-12-9-13(2)20-17(19-12)21-18-11-14-10-15(23(24)25)3-4-16(14)22-5-7-26-8-6-22/h3-4,9-11H,5-8H2,1-2H3,(H,19,20,21)/b18-11+