N4-butan-2-yl-5-nitro-N6-quinolin-8-yl-pyrimidine-4,6-diamine

Systemtic Name: N4-butan-2-yl-5-nitro-N6-quinolin-8-yl-pyrimidine-4,6-diamine Openeye Name: 5-nitro-N6-(8-quinolyl)-N4-sec-butyl-pyrimidine-4,6-diamine CAS Name: N4-butan-2-yl-5-nitro-N6-(8-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-butan-2-yl-5-nitro-6-N-quinolin-8-ylpyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(8-quinolylamino)pyrimidin-4-yl]-sec-butyl-amine Formula: C17H18N6O2 MolecularWeight: 338.36382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CCC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C17H18N6O2/c1-3-11(2)21-16-15(23(24)25)17(20-10-19-16)22-13-8-4-6-12-7-5-9-18-14(12)13/h4-11H,3H2,1-2H3,(H2,19,20,21,22)