N6-cycloheptyl-N4-ethyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N6-cycloheptyl-N4-ethyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N6-cycloheptyl-N4-ethyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N6-cycloheptyl-N4-ethyl-5-nitro-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 6-N-cycloheptyl-4-N-ethyl-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: [6-(cycloheptylamino)-5-nitro-pyrimidin-4-yl]-ethyl-phenyl-amine Formula: C19H25N5O2 MolecularWeight: 355.4341

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3CCCCCC3

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3CCCCCC3

InChI

InChI=1S/C19H25N5O2/c1-2-23(16-12-8-5-9-13-16)19-17(24(25)26)18(20-14-21-19)22-15-10-6-3-4-7-11-15/h5,8-9,12-15H,2-4,6-7,10-11H2,1H3,(H,20,21,22)