2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazole

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazole Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazole CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-6-phenylimidazo[2,1-b][1,3,4]thiadiazole IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-phenylimidazo[2,1-b][1,3,4]thiadiazole Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-phenyl-imidazo[2,1-b][1,3,4]thiadiazole Formula: C16H20N5S+ MolecularWeight: 314.4285

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NN3C=C(N=C3S2)C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NN3C=C(N=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C16H19N5S/c1-2-19-8-10-20(11-9-19)16-18-21-12-14(17-15(21)22-16)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3/p+1