N4-cycloheptyl-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-cycloheptyl-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-cycloheptyl-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-cycloheptyl-N6-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-cycloheptyl-6-N-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: cycloheptyl-[6-(2-ethylanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C19H25N5O2 MolecularWeight: 355.4341

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N5O2/c1-2-14-9-7-8-12-16(14)23-19-17(24(25)26)18(20-13-21-19)22-15-10-5-3-4-6-11-15/h7-9,12-13,15H,2-6,10-11H2,1H3,(H2,20,21,22,23)