3-[5-(4-fluoranylphenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]-1-(4-methylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[5-(4-fluoranylphenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]-1-(4-methylpiperazin-1-yl)propan-1-one Openeye Name: 3-[5-(4-fluorophenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]-1-(4-methylpiperazin-1-yl)propan-1-one CAS Name: 3-[5-(4-fluorophenoxy)-1-(4-methoxyphenyl)-3-methyl-4-pyrazolyl]-1-(4-methyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[5-(4-fluorophenoxy)-1-(4-methoxyphenyl)-3-methylpyrazol-4-yl]-1-(4-methylpiperazin-1-yl)propan-1-one Traditional Name: 3-[5-(4-fluorophenoxy)-1-(4-methoxyphenyl)-3-methyl-pyrazol-4-yl]-1-(4-methylpiperazino)propan-1-one Formula: C25H29FN4O3 MolecularWeight: 452.521163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CCC(=O)N2CCN(CC2)C)OC3=CC=C(C=C3)F)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NN(C(=C1CCC(=O)N2CCN(CC2)C)OC3=CC=C(C=C3)F)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H29FN4O3/c1-18-23(12-13-24(31)29-16-14-28(2)15-17-29)25(33-22-8-4-19(26)5-9-22)30(27-18)20-6-10-21(32-3)11-7-20/h4-11H,12-17H2,1-3H3