4-[[4-(4-fluoranyl-2-nitro-phenyl)piperazin-1-ium-1-yl]methyl]-2-(furan-2-yl)-1,3-thiazole

Systemtic Name: 4-[[4-(4-fluoranyl-2-nitro-phenyl)piperazin-1-ium-1-yl]methyl]-2-(furan-2-yl)-1,3-thiazole Openeye Name: 4-[[4-(4-fluoro-2-nitro-phenyl)piperazin-1-ium-1-yl]methyl]-2-(2-furyl)thiazole CAS Name: 4-[[4-(4-fluoro-2-nitrophenyl)-1-piperazin-1-iumyl]methyl]-2-(2-furanyl)thiazole IUPAC Name: 4-[[4-(4-fluoro-2-nitrophenyl)piperazin-1-ium-1-yl]methyl]-2-(furan-2-yl)-1,3-thiazole Traditional Name: 4-[[4-(4-fluoro-2-nitro-phenyl)piperazin-1-ium-1-yl]methyl]-2-(2-furyl)thiazole Formula: C18H18FN4O3S+ MolecularWeight: 389.423923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC(=N2)C3=CC=CO3)C4=C(C=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC(=N2)C3=CC=CO3)C4=C(C=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C18H17FN4O3S/c19-13-3-4-15(16(10-13)23(24)25)22-7-5-21(6-8-22)11-14-12-27-18(20-14)17-2-1-9-26-17/h1-4,9-10,12H,5-8,11H2/p+1