2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate

Systemtic Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate Openeye Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate CAS Name: 2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate IUPAC Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate Traditional Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetimidate Formula: C17H22FN5OS MolecularWeight: 363.452883

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)N=C(C[NH+]2CCN(CC2)C3=CC=CC=C3F)[O-]

Isomeric SMILES

CCCC1=NN=C(S1)N=C(C[NH+]2CCN(CC2)C3=CC=CC=C3F)[O-]

InChI

InChI=1S/C17H22FN5OS/c1-2-5-16-20-21-17(25-16)19-15(24)12-22-8-10-23(11-9-22)14-7-4-3-6-13(14)18/h3-4,6-7H,2,5,8-12H2,1H3,(H,19,21,24)