2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate

Systemtic Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate Openeye Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate CAS Name: 2-(4-phenyl-1-piperazin-1-iumyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate IUPAC Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanimidate Traditional Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetimidate Formula: C17H23N5OS MolecularWeight: 345.46242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5OS/c1-2-6-16-19-20-17(24-16)18-15(23)13-21-9-11-22(12-10-21)14-7-4-3-5-8-14/h3-5,7-8H,2,6,9-13H2,1H3,(H,18,20,23)