N6-(2,3-dimethylphenyl)-N4-(2,4-dimethylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(2,3-dimethylphenyl)-N4-(2,4-dimethylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(2,3-dimethylphenyl)-N4-(2,4-dimethylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(2,3-dimethylphenyl)-N4-(2,4-dimethylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(2,3-dimethylphenyl)-4-N-(2,4-dimethylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2,3-dimethylanilino)-5-nitro-pyrimidin-4-yl]-(2,4-dimethylphenyl)amine Formula: C20H21N5O2 MolecularWeight: 363.41304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC(=C3C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC(=C3C)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H21N5O2/c1-12-8-9-16(14(3)10-12)23-19-18(25(26)27)20(22-11-21-19)24-17-7-5-6-13(2)15(17)4/h5-11H,1-4H3,(H2,21,22,23,24)