N4-butyl-N4-methyl-5-nitro-N6-pyridin-3-yl-pyrimidine-4,6-diamine

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N6O2/c1-3-4-8-19(2)14-12(20(21)22)13(16-10-17-14)18-11-6-5-7-15-9-11/h5-7,9-10H,3-4,8H2,1-2H3,(H,16,17,18)