N2-(4-chlorophenyl)-N4-[3-(dimethylamino)-2,2-dimethyl-propyl]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(4-chlorophenyl)-N4-[3-(dimethylamino)-2,2-dimethyl-propyl]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-(4-chlorophenyl)-N4-[3-(dimethylamino)-2,2-dimethyl-propyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(4-chlorophenyl)-N4-[3-(dimethylamino)-2,2-dimethylpropyl]-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(4-chlorophenyl)-4-N-[3-(dimethylamino)-2,2-dimethylpropyl]-5-nitropyrimidine-2,4-diamine Traditional Name: [3-[[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]amino]-2,2-dimethyl-propyl]-dimethyl-amine Formula: C17H23ClN6O2 MolecularWeight: 378.85652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl)CN(C)C

Isomeric SMILES

CC(C)(CNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl)CN(C)C

InChI

InChI=1S/C17H23ClN6O2/c1-17(2,11-23(3)4)10-20-15-14(24(25)26)9-19-16(22-15)21-13-7-5-12(18)6-8-13/h5-9H,10-11H2,1-4H3,(H2,19,20,21,22)