1-[[3-(2,5-dimethylthiophen-3-yl)-1-(2-fluorophenyl)pyrazol-4-yl]methyl]-4-pyridin-2-yl-piperazine

Systemtic Name: 1-[[3-(2,5-dimethylthiophen-3-yl)-1-(2-fluorophenyl)pyrazol-4-yl]methyl]-4-pyridin-2-yl-piperazine Openeye Name: 1-[[3-(2,5-dimethyl-3-thienyl)-1-(2-fluorophenyl)pyrazol-4-yl]methyl]-4-(2-pyridyl)piperazine CAS Name: 1-[[3-(2,5-dimethyl-3-thiophenyl)-1-(2-fluorophenyl)-4-pyrazolyl]methyl]-4-(2-pyridinyl)piperazine IUPAC Name: 1-[[3-(2,5-dimethylthiophen-3-yl)-1-(2-fluorophenyl)pyrazol-4-yl]methyl]-4-pyridin-2-ylpiperazine Traditional Name: 1-[[3-(2,5-dimethyl-3-thienyl)-1-(2-fluorophenyl)pyrazol-4-yl]methyl]-4-(2-pyridyl)piperazine Formula: C25H26FN5S MolecularWeight: 447.570843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NN(C=C2CN3CCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5F

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NN(C=C2CN3CCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5F

InChI

InChI=1S/C25H26FN5S/c1-18-15-21(19(2)32-18)25-20(17-31(28-25)23-8-4-3-7-22(23)26)16-29-11-13-30(14-12-29)24-9-5-6-10-27-24/h3-10,15,17H,11-14,16H2,1-2H3