4-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(4-isopropylphenoxy)-5-nitro-pyrimidine CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-6-(4-isopropylphenoxy)-5-nitro-pyrimidine Formula: C23H24FN5O3 MolecularWeight: 437.466763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H24FN5O3/c1-16(2)17-3-9-20(10-4-17)32-23-21(29(30)31)22(25-15-26-23)28-13-11-27(12-14-28)19-7-5-18(24)6-8-19/h3-10,15-16H,11-14H2,1-2H3