5-nitro-N2-phenyl-6-piperidin-1-yl-pyrimidine-2,4-diamine

Systemtic Name: 5-nitro-N2-phenyl-6-piperidin-1-yl-pyrimidine-2,4-diamine Openeye Name: 5-nitro-N2-phenyl-6-(1-piperidyl)pyrimidine-2,4-diamine CAS Name: 5-nitro-N2-phenyl-6-(1-piperidinyl)pyrimidine-2,4-diamine IUPAC Name: 5-nitro-2-N-phenyl-6-piperidin-1-ylpyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-6-piperidino-pyrimidin-2-yl)-phenyl-amine Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=NC(=N2)NC3=CC=CC=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=NC(=N2)NC3=CC=CC=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O2/c16-13-12(21(22)23)14(20-9-5-2-6-10-20)19-15(18-13)17-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H3,16,17,18,19)