methyl 2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[4-(4-fluorophenyl)-1-piperazinyl]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[4-(4-fluorophenyl)piperazino]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C17H19FN4O3 MolecularWeight: 346.356163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H19FN4O3/c1-25-16(24)11-13-10-15(23)20-17(19-13)22-8-6-21(7-9-22)14-4-2-12(18)3-5-14/h2-5,10H,6-9,11H2,1H3,(H,19,20,23)