N2-(2,6-dimethylphenyl)-N4-(2-methoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(2,6-dimethylphenyl)-N4-(2-methoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-(2,6-dimethylphenyl)-N4-(2-methoxyphenyl)-6-methyl-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(2,6-dimethylphenyl)-N4-(2-methoxyphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(2,6-dimethylphenyl)-4-N-(2-methoxyphenyl)-6-methyl-5-nitropyrimidine-2,4-diamine Traditional Name: [2-(2,6-dimethylanilino)-6-methyl-5-nitro-pyrimidin-4-yl]-(2-methoxyphenyl)amine Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NC(=C(C(=N2)NC3=CC=CC=C3OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NC(=C(C(=N2)NC3=CC=CC=C3OC)[N+](=O)[O-])C

InChI

InChI=1S/C20H21N5O3/c1-12-8-7-9-13(2)17(12)23-20-21-14(3)18(25(26)27)19(24-20)22-15-10-5-6-11-16(15)28-4/h5-11H,1-4H3,(H2,21,22,23,24)