N6-(3-methylbutyl)-5-nitro-N4-pyridin-4-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-(3-methylbutyl)-5-nitro-N4-pyridin-4-yl-pyrimidine-4,6-diamine Openeye Name: N6-isopentyl-5-nitro-N4-(4-pyridyl)pyrimidine-4,6-diamine CAS Name: N6-(3-methylbutyl)-5-nitro-N4-pyridin-4-ylpyrimidine-4,6-diamine IUPAC Name: 6-N-(3-methylbutyl)-5-nitro-4-N-pyridin-4-ylpyrimidine-4,6-diamine Traditional Name: isoamyl-[5-nitro-6-(4-pyridylamino)pyrimidin-4-yl]amine Formula: C14H18N6O2 MolecularWeight: 302.33172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=NC=C2

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=NC=C2

InChI

InChI=1S/C14H18N6O2/c1-10(2)3-8-16-13-12(20(21)22)14(18-9-17-13)19-11-4-6-15-7-5-11/h4-7,9-10H,3,8H2,1-2H3,(H2,15,16,17,18,19)