4-[[1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]carbonyl]piperazin-2-one

Systemtic Name: 4-[[1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]carbonyl]piperazin-2-one Openeye Name: 4-[1-(3-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carbonyl]piperazin-2-one CAS Name: 4-[[1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]-oxomethyl]-2-piperazinone IUPAC Name: 4-[1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carbonyl]piperazin-2-one Traditional Name: 4-[1-(3-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carbonyl]piperazin-2-one Formula: C17H14FN5O2S MolecularWeight: 371.388763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)C2=NN(C(=N2)C3=CC=CS3)C4=CC(=CC=C4)F

InChI

InChI=1S/C17H14FN5O2S/c18-11-3-1-4-12(9-11)23-16(13-5-2-8-26-13)20-15(21-23)17(25)22-7-6-19-14(24)10-22/h1-5,8-9H,6-7,10H2,(H,19,24)