N-[(4-fluorophenyl)methyl]-6-(4-methylphenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[(4-fluorophenyl)methyl]-6-(4-methylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: N-[(4-fluorophenyl)methyl]-6-(4-methylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-[(4-fluorophenyl)methyl]-6-(4-methylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-[(4-fluorophenyl)methyl]-6-(4-methylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: (4-fluorobenzyl)-[6-(4-methylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C18H15FN4O3 MolecularWeight: 354.335103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H15FN4O3/c1-12-2-8-15(9-3-12)26-18-16(23(24)25)17(21-11-22-18)20-10-13-4-6-14(19)7-5-13/h2-9,11H,10H2,1H3,(H,20,21,22)