5-nitro-N4,N6-bis(4-propan-2-ylphenyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4,N6-bis(4-propan-2-ylphenyl)pyrimidine-4,6-diamine Openeye Name: N4,N6-bis(4-isopropylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: 5-nitro-N4,N6-bis(4-propan-2-ylphenyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N,6-N-bis(4-propan-2-ylphenyl)pyrimidine-4,6-diamine Traditional Name: (6-cumidino-5-nitro-pyrimidin-4-yl)-p-cumenyl-amine Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=C(C=C3)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O2/c1-14(2)16-5-9-18(10-6-16)25-21-20(27(28)29)22(24-13-23-21)26-19-11-7-17(8-12-19)15(3)4/h5-15H,1-4H3,(H2,23,24,25,26)