N-butyl-6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-butyl-6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-butyl-6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-butyl-6-(3,5-dimethyl-1-pyrazolyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-butyl-6-(3,5-dimethylpyrazol-1-yl)-5-nitropyrimidin-4-amine Traditional Name: butyl-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]amine Formula: C13H18N6O2 MolecularWeight: 290.32102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2C(=CC(=N2)C)C

Isomeric SMILES

CCCCNC1=NC=NC(=C1[N+](=O)[O-])N2C(=CC(=N2)C)C

InChI

InChI=1S/C13H18N6O2/c1-4-5-6-14-12-11(19(20)21)13(16-8-15-12)18-10(3)7-9(2)17-18/h7-8H,4-6H2,1-3H3,(H,14,15,16)