3-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-propan-2-yl-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-propan-2-yl-1,3,4-oxadiazole-2-thione Openeye Name: 3-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-isopropyl-1,3,4-oxadiazole-2-thione CAS Name: 3-[[4-(4-fluorophenyl)-1-piperazin-1-iumyl]methyl]-5-propan-2-yl-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-propan-2-yl-1,3,4-oxadiazole-2-thione Traditional Name: 3-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-isopropyl-1,3,4-oxadiazole-2-thione Formula: C16H22FN4OS+ MolecularWeight: 337.435483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=S)O1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=NN(C(=S)O1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H21FN4OS/c1-12(2)15-18-21(16(23)22-15)11-19-7-9-20(10-8-19)14-5-3-13(17)4-6-14/h3-6,12H,7-11H2,1-2H3/p+1