[4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]methylazanium

Systemtic Name: [4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]methylazanium Openeye Name: [4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]thiazol-2-yl]methylammonium CAS Name: [4-[[4-(4-fluorophenyl)-1-piperazin-1-iumyl]methyl]-2-thiazolyl]methylammonium IUPAC Name: [4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]methylazanium Traditional Name: [4-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]thiazol-2-yl]methylammonium Formula: C15H21FN4S+2 MolecularWeight: 308.417443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC(=N2)C[NH3+])C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC(=N2)C[NH3+])C3=CC=C(C=C3)F

InChI

InChI=1S/C15H19FN4S/c16-12-1-3-14(4-2-12)20-7-5-19(6-8-20)10-13-11-21-15(9-17)18-13/h1-4,11H,5-10,17H2/p+2