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

Systemtic Name: N-butan-2-yl-6-(4-methylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-methylphenoxy)-5-nitro-N-sec-butyl-pyrimidin-4-amine CAS Name: N-butan-2-yl-6-(4-methylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-butan-2-yl-6-(4-methylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-methylphenoxy)-5-nitro-pyrimidin-4-yl]-sec-butyl-amine Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=NC=N1)OC2=CC=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC1=C(C(=NC=N1)OC2=CC=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O3/c1-4-11(3)18-14-13(19(20)21)15(17-9-16-14)22-12-7-5-10(2)6-8-12/h5-9,11H,4H2,1-3H3,(H,16,17,18)