N4-butan-2-yl-N6-cycloheptyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-butan-2-yl-N6-cycloheptyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-cycloheptyl-5-nitro-N4-sec-butyl-pyrimidine-4,6-diamine CAS Name: N4-butan-2-yl-N6-cycloheptyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butan-2-yl-6-N-cycloheptyl-5-nitropyrimidine-4,6-diamine Traditional Name: cycloheptyl-[5-nitro-6-(sec-butylamino)pyrimidin-4-yl]amine Formula: C15H25N5O2 MolecularWeight: 307.3913

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2CCCCCC2

Isomeric SMILES

CCC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2CCCCCC2

InChI

InChI=1S/C15H25N5O2/c1-3-11(2)18-14-13(20(21)22)15(17-10-16-14)19-12-8-6-4-5-7-9-12/h10-12H,3-9H2,1-2H3,(H2,16,17,18,19)