2-methyl-5-nitro-N4,N6-bis(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine

Systemtic Name: 2-methyl-5-nitro-N4,N6-bis(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine Openeye Name: 2-methyl-5-nitro-N4,N6-bis(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine CAS Name: 2-methyl-5-nitro-N4,N6-bis(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine IUPAC Name: 2-methyl-5-nitro-4-N,6-N-bis(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine Traditional Name: (6-mesidino-2-methyl-5-nitro-pyrimidin-4-yl)-mesityl-amine Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N5O2/c1-12-8-14(3)19(15(4)9-12)26-22-21(28(29)30)23(25-18(7)24-22)27-20-16(5)10-13(2)11-17(20)6/h8-11H,1-7H3,(H2,24,25,26,27)