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

Systemtic Name: N4-cycloheptyl-N6-(3,5-dimethylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-cycloheptyl-N6-(3,5-dimethylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-cycloheptyl-N6-(3,5-dimethylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-cycloheptyl-6-N-(3,5-dimethylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: cycloheptyl-[6-(3,5-dimethylanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C19H25N5O2 MolecularWeight: 355.4341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NC3CCCCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NC3CCCCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C19H25N5O2/c1-13-9-14(2)11-16(10-13)23-19-17(24(25)26)18(20-12-21-19)22-15-7-5-3-4-6-8-15/h9-12,15H,3-8H2,1-2H3,(H2,20,21,22,23)