N4-cyclohexyl-5-nitro-N2-phenyl-pyrimidine-2,4,6-triamine

Systemtic Name: N4-cyclohexyl-5-nitro-N2-phenyl-pyrimidine-2,4,6-triamine Openeye Name: N4-cyclohexyl-5-nitro-N2-phenyl-pyrimidine-2,4,6-triamine CAS Name: N4-cyclohexyl-5-nitro-N2-phenylpyrimidine-2,4,6-triamine IUPAC Name: 4-N-cyclohexyl-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine Traditional Name: (6-amino-2-anilino-5-nitro-pyrimidin-4-yl)-cyclohexyl-amine Formula: C16H20N6O2 MolecularWeight: 328.369

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC=CC=C3

InChI

InChI=1S/C16H20N6O2/c17-14-13(22(23)24)15(18-11-7-3-1-4-8-11)21-16(20-14)19-12-9-5-2-6-10-12/h2,5-6,9-11H,1,3-4,7-8H2,(H4,17,18,19,20,21)