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

Systemtic Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)ethanimidate Openeye Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)ethanimidate CAS Name: 2-(4-phenyl-1-piperazin-1-iumyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)ethanimidate IUPAC Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)ethanimidate Traditional Name: 2-(4-phenylpiperazin-1-ium-1-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetimidate Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=NC2=NN=C(S2)C3=CC=CC=C3)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=NC2=NN=C(S2)C3=CC=CC=C3)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H21N5OS/c26-18(21-20-23-22-19(27-20)16-7-3-1-4-8-16)15-24-11-13-25(14-12-24)17-9-5-2-6-10-17/h1-10H,11-15H2,(H,21,23,26)