1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[[5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[[5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[[5-(2-methyl-3-furyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-[4-(2-fluorophenyl)-1-piperazinyl]-2-[[5-(2-methyl-3-furanyl)-4-phenyl-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[[5-(2-methylfuran-3-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-[4-(2-fluorophenyl)piperazino]-2-[[5-(2-methyl-3-furyl)-4-phenyl-1,2,4-triazol-3-yl]thio]ethanone Formula: C25H24FN5O2S MolecularWeight: 477.553763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)N4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)N4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C25H24FN5O2S/c1-18-20(11-16-33-18)24-27-28-25(31(24)19-7-3-2-4-8-19)34-17-23(32)30-14-12-29(13-15-30)22-10-6-5-9-21(22)26/h2-11,16H,12-15,17H2,1H3