2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)ethanimidate

Systemtic Name: 2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-ium-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)ethanimidate Openeye Name: 2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)ethanimidate CAS Name: 2-[4-(5-chloro-2-methylphenyl)-1-piperazin-1-iumyl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)ethanimidate IUPAC Name: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-ium-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)ethanimidate Traditional Name: 2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-ium-1-yl]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetimidate Formula: C17H22ClN5OS MolecularWeight: 379.90748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)N=C(C[NH+]2CCN(CC2)C3=C(C=CC(=C3)Cl)C)[O-]

Isomeric SMILES

CCC1=NN=C(S1)N=C(C[NH+]2CCN(CC2)C3=C(C=CC(=C3)Cl)C)[O-]

InChI

InChI=1S/C17H22ClN5OS/c1-3-16-20-21-17(25-16)19-15(24)11-22-6-8-23(9-7-22)14-10-13(18)5-4-12(14)2/h4-5,10H,3,6-9,11H2,1-2H3,(H,19,21,24)