N-butan-2-yl-6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-butan-2-yl-6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-ethylphenoxy)-5-nitro-N-sec-butyl-pyrimidin-4-amine CAS Name: N-butan-2-yl-6-(4-ethylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-butan-2-yl-6-(4-ethylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-ethylphenoxy)-5-nitro-pyrimidin-4-yl]-sec-butyl-amine Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC(C)CC

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC(C)CC

InChI

InChI=1S/C16H20N4O3/c1-4-11(3)19-15-14(20(21)22)16(18-10-17-15)23-13-8-6-12(5-2)7-9-13/h6-11H,4-5H2,1-3H3,(H,17,18,19)