N4-tert-butyl-N6-(4-chloranyl-2-methyl-phenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-tert-butyl-N6-(4-chloranyl-2-methyl-phenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-tert-butyl-N6-(4-chloro-2-methyl-phenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-tert-butyl-N6-(4-chloro-2-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-tert-butyl-6-N-(4-chloro-2-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: tert-butyl-[6-(4-chloro-2-methyl-anilino)-5-nitro-pyrimidin-4-yl]amine Formula: C15H18ClN5O2 MolecularWeight: 335.78872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC2=C(C(=NC=N2)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC2=C(C(=NC=N2)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H18ClN5O2/c1-9-7-10(16)5-6-11(9)19-13-12(21(22)23)14(18-8-17-13)20-15(2,3)4/h5-8H,1-4H3,(H2,17,18,19,20)