N-ethyl-6-(3-methylpiperidin-1-yl)-5-nitro-N-phenyl-pyrimidin-4-amine

Systemtic Name: N-ethyl-6-(3-methylpiperidin-1-yl)-5-nitro-N-phenyl-pyrimidin-4-amine Openeye Name: N-ethyl-6-(3-methyl-1-piperidyl)-5-nitro-N-phenyl-pyrimidin-4-amine CAS Name: N-ethyl-6-(3-methyl-1-piperidinyl)-5-nitro-N-phenyl-4-pyrimidinamine IUPAC Name: N-ethyl-6-(3-methylpiperidin-1-yl)-5-nitro-N-phenylpyrimidin-4-amine Traditional Name: ethyl-[6-(3-methylpiperidino)-5-nitro-pyrimidin-4-yl]-phenyl-amine Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCCC(C3)C

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCCC(C3)C

InChI

InChI=1S/C18H23N5O2/c1-3-22(15-9-5-4-6-10-15)18-16(23(24)25)17(19-13-20-18)21-11-7-8-14(2)12-21/h4-6,9-10,13-14H,3,7-8,11-12H2,1-2H3