N2-(4-chlorophenyl)-N4-cyclohexyl-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N2-(4-chlorophenyl)-N4-cyclohexyl-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2-(4-chlorophenyl)-N4-cyclohexyl-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2-(4-chlorophenyl)-N4-cyclohexyl-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N-(4-chlorophenyl)-4-N-cyclohexyl-5-nitropyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-cyclohexyl-amine Formula: C16H19ClN6O2 MolecularWeight: 362.81406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19ClN6O2/c17-10-6-8-12(9-7-10)20-16-21-14(18)13(23(24)25)15(22-16)19-11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H4,18,19,20,21,22)