N4-(1-adamantyl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(1-adamantyl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(1-adamantyl)-N6-isopentyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(1-adamantyl)-N6-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(1-adamantyl)-6-N-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 1-adamantyl-[6-(isoamylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C19H29N5O2 MolecularWeight: 359.46586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H29N5O2/c1-12(2)3-4-20-17-16(24(25)26)18(22-11-21-17)23-19-8-13-5-14(9-19)7-15(6-13)10-19/h11-15H,3-10H2,1-2H3,(H2,20,21,22,23)